| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 33.7 | Very low | 36.3 | Very low | 226 Ų | 226 | 139.5 Ų | 139.5 | 100% | 1.113 | 80% | 0.8 | S | S | * | * | 0 | 101.4 | 0 | -81.4 | 174.3 | 131.8 | 0 | 0 | 107.4 | |||||
| 2 | D | 37.8 | Very low | 35.7 | Very low | 135 Ų | 135 | 141.8 Ų | 141.8 | 72% | 0.722 | 80% | 0.798 | S | S | * | * | cis | -157.2 | 128.3 | -0.9 | -78.7 | -49.7 | 0 | 0 | 0 | 106.5 | ||||
| 3 | E | 38.2 | Very low | 35.2 | Very low | 188 Ų | 188 | 139.5 Ų | 139.5 | 88% | 0.879 | 78% | 0.783 | S | S | * | * | trans | 39 | 161.8 | 143.4 | -93.9 | -164.8 | 121 | 0 | 0 | 124.5 | ||||
| 4 | P | 52.6 | Low | 34.6 | Very low | 92 Ų | 92 | 138.9 Ų | 138.9 | 60% | 0.597 | 78% | 0.776 | S | S | * | * | -129.1 | -165.2 | -126 | 37.8 | -14.8 | 0 | 0 | 0 | 114.2 | |||||
| 5 | D | 33.4 | Very low | 34 | Very low | 142 Ų | 142 | 139.1 Ų | 139.1 | 76% | 0.759 | 77% | 0.774 | S | S | * | * | trans | 58.4 | 130.6 | 152.3 | -69.1 | -24.4 | 0 | 0 | 0 | 121.1 | ||||
| 6 | T | 34.1 | Very low | 33.4 | Very low | 133 Ų | 133 | 137.3 Ų | 137.3 | 82% | 0.816 | 77% | 0.774 | S | S | * | * | 149.8 | 138.1 | 107.7 | -49.9 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 7 | A | 30.1 | Very low | 33 | Very low | 96 Ų | 96 | 134.5 Ų | 134.5 | 79% | 0.793 | 77% | 0.772 | S | S | * | * | trans | 6.1 | 150.3 | 159.6 | 0 | 0 | 0 | 0 | 0 | 124.4 | ||||
| 8 | A | 31.6 | Very low | 32.6 | Very low | 89 Ų | 89 | 133.2 Ų | 133.2 | 74% | 0.736 | 77% | 0.772 | S | S | * | * | trans | -47.6 | 154.6 | 171.6 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 9 | I | 26.7 | Very low | 32.2 | Very low | 173 Ų | 173 | 131.4 Ų | 131.4 | 89% | 0.887 | 77% | 0.767 | S | S | * | * | trans | -175.2 | 136 | 144.4 | -88.8 | 145.8 | 0 | 0 | 0 | 108.7 | ||||
| 10 | L | 29.1 | Very low | 32 | Very low | 156 Ų | 156 | 130.6 Ų | 130.6 | 82% | 0.817 | 77% | 0.765 | S | S | * | * | trans | -78.6 | -176.4 | 166 | -79.6 | 155.5 | 0 | 0 | 0 | 110.1 | ||||
| 11 | P | 52 | Low | 31.7 | Very low | 104 Ų | 104 | 130.8 Ų | 130.8 | 68% | 0.675 | 76% | 0.762 | S | S | * | * | cis | -126.5 | -155.7 | -49.8 | 35.2 | -14.3 | 0 | 0 | 0 | 110.2 | ||||
| 12 | E | 29.2 | Very low | 31.3 | Very low | 168 Ų | 168 | 126 Ų | 126 | 79% | 0.785 | 74% | 0.742 | S | S | * | * | trans | 74 | 138.4 | 165.9 | -76.1 | -171 | 171.7 | 0 | 0 | 116 | ||||
| 13 | D | 29.4 | Very low | 30.7 | Very low | 111 Ų | 111 | 127.2 Ų | 127.2 | 59% | 0.594 | 74% | 0.743 | S | S | * | * | cis | -178.2 | 173.1 | 21.7 | -134.8 | -10.7 | 0 | 0 | 0 | 112.3 | ||||
| 14 | L | 26.7 | Very low | 30.3 | Very low | 132 Ų | 132 | 125.8 Ų | 125.8 | 69% | 0.691 | 74% | 0.74 | S | S | * | * | trans | 73.7 | 129.3 | 146.9 | -66.3 | 152.2 | 0 | 0 | 0 | 117.7 | ||||
| 15 | L | 26 | Very low | 28.9 | Very low | 142 Ų | 142 | 126.7 Ų | 126.7 | 74% | 0.743 | 75% | 0.749 | S | S | * | * | cis | -168.9 | 154.7 | 20.6 | -105.6 | 157.5 | 0 | 0 | 0 | 111.8 | ||||
| 16 | S | 24.2 | Very low | 28.5 | Very low | 110 Ų | 110 | 127 Ų | 127 | 77% | 0.769 | 75% | 0.751 | S | S | * | * | trans | 71.8 | 107 | 149.1 | 67.6 | 0 | 0 | 0 | 0 | 119 | ||||
| 17 | A | 26.1 | Very low | 28.1 | Very low | 90 Ų | 90 | 125.3 Ų | 125.3 | 74% | 0.744 | 74% | 0.744 | S | S | * | * | -177.7 | 120.3 | 82 | 0 | 0 | 0 | 0 | 0 | 112 | |||||
| 18 | S | 25.5 | Very low | 28 | Very low | 111 Ų | 111 | 129.5 Ų | 129.5 | 78% | 0.776 | 75% | 0.747 | S | S | * | * | trans | 51.4 | 135 | 144.4 | 62.3 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 19 | S | 26 | Very low | 27.8 | Very low | 98 Ų | 98 | 133.4 Ų | 133.4 | 69% | 0.685 | 76% | 0.756 | S | S | * | * | cis | 178.8 | 133.3 | 0.4 | 45.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 20 | T | 27.5 | Very low | 27.7 | Very low | 116 Ų | 116 | 135 Ų | 135 | 71% | 0.712 | 75% | 0.751 | S | S | * | * | trans | 47.5 | 133 | 138.6 | 53.8 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 21 | D | 25.2 | Very low | 27.7 | Very low | 134 Ų | 134 | 135.1 Ų | 135.1 | 72% | 0.717 | 75% | 0.745 | S | S | * | * | cis | -165.3 | 144.4 | 22.4 | -96.2 | -24 | 0 | 0 | 0 | 110.5 | ||||
| 22 | D | 26.8 | Very low | 26.5 | Very low | 127 Ų | 127 | 136.4 Ų | 136.4 | 68% | 0.679 | 75% | 0.746 | S | S | * | * | trans | 38.6 | 147.2 | 130.9 | -73 | 1.9 | 0 | 0 | 0 | 122 | ||||
| 23 | Q | 25.1 | Very low | 26.4 | Very low | 159 Ų | 159 | 137.2 Ų | 137.2 | 74% | 0.743 | 75% | 0.75 | S | S | * | * | cis | -169.4 | 167.2 | 4.7 | -118.8 | 179.7 | 47.2 | 0 | 0 | 109.1 | ||||
| 24 | L | 28.5 | Very low | 26.3 | Very low | 158 Ų | 158 | 136.8 Ų | 136.8 | 83% | 0.827 | 76% | 0.761 | S | S | * | * | trans | -53.9 | 151.2 | 169.7 | -74.8 | 81.8 | 0 | 0 | 0 | 114.3 | ||||
| 25 | S | 23.9 | Very low | 26.3 | Very low | 111 Ų | 111 | 134.2 Ų | 134.2 | 78% | 0.776 | 77% | 0.767 | S | S | * | * | 169.5 | 146.2 | 117.2 | 50.3 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 26 | D | 25.4 | Very low | 26.4 | Very low | 149 Ų | 149 | 135.6 Ų | 135.6 | 80% | 0.797 | 77% | 0.774 | S | S | * | * | trans | 59.6 | 137.9 | 139.4 | -83.8 | -22.1 | 0 | 0 | 0 | 126 | ||||
| 27 | S | 25.2 | Very low | 26.8 | Very low | 97 Ų | 97 | 135.9 Ų | 135.9 | 68% | 0.678 | 77% | 0.774 | S | S | * | * | trans | 71.1 | 122.6 | 134.8 | 65 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 28 | E | 28.8 | Very low | 26.9 | Very low | 184 Ų | 184 | 138.3 Ų | 138.3 | 86% | 0.86 | 78% | 0.779 | S | S | * | * | trans | 27.8 | 118.3 | 134.5 | -61.5 | -173.2 | 126 | 0 | 0 | 118.5 | ||||
| 29 | D | 27.1 | Very low | 27.1 | Very low | 172 Ų | 172 | 137.9 Ų | 137.9 | 92% | 0.92 | 78% | 0.783 | S | S | * | * | -155.3 | 150.9 | 123.1 | -120.8 | -28.8 | 0 | 0 | 0 | 114.5 | |||||
| 30 | R | 25.1 | Very low | 27.4 | Very low | 205 Ų | 205 | 139.6 Ų | 139.6 | 77% | 0.774 | 79% | 0.789 | S | S | * | * | trans | -104.2 | 157.6 | -166.7 | -149.5 | -174.3 | -171.6 | 177.3 | 4.2 | 109.6 | ||||
| 31 | K | 27.3 | Very low | 27.6 | Very low | 159 Ų | 159 | 141.1 Ų | 141.1 | 69% | 0.691 | 80% | 0.798 | S | S | * | * | trans | 74.8 | 147.3 | 158.5 | -67.4 | -179.8 | 171.6 | -173.1 | 0 | 116 | ||||
| 32 | D | 27.5 | Very low | 27.9 | Very low | 132 Ų | 132 | 140 Ų | 140 | 71% | 0.706 | 80% | 0.801 | S | S | * | * | cis | -167 | 138.9 | -3.1 | -90.4 | -31.4 | 0 | 0 | 0 | 101.2 | ||||
| 33 | E | 27.5 | Very low | 28.7 | Very low | 184 Ų | 184 | 140.2 Ų | 140.2 | 86% | 0.86 | 81% | 0.807 | S | S | * | * | 164.1 | 124 | 82 | -122.8 | 177.3 | 174.1 | 0 | 0 | 106.2 | |||||
| 34 | A | 27.6 | Very low | 29.2 | Very low | 102 Ų | 102 | 137.5 Ų | 137.5 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | 70 | 110.7 | 112.9 | 0 | 0 | 0 | 0 | 0 | 118 | |||||
| 35 | G | 25.9 | Very low | 29.6 | Very low | 79 Ų | 79 | 135.8 Ų | 135.8 | 81% | 0.814 | 80% | 0.801 | S | S | * | * | trans | 175.4 | 65.2 | 169.8 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 36 | L | 28.4 | Very low | 30.4 | Very low | 170 Ų | 170 | 134.7 Ų | 134.7 | 89% | 0.89 | 79% | 0.794 | S | S | * | * | trans | 43.2 | 123.9 | 153 | -140.2 | 73.9 | 0 | 0 | 0 | 122.4 | ||||
| 37 | P | 31.8 | Very low | 30.9 | Very low | 116 Ų | 116 | 134 Ų | 134 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -89.3 | 148.5 | 172.6 | 28.9 | -21.2 | 0 | 0 | 0 | 114.8 | ||
| 38 | T | 29.6 | Very low | 31.3 | Very low | 141 Ų | 141 | 140 Ų | 140 | 87% | 0.865 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -52 | 138.9 | 175.3 | 25 | 0 | 0 | 0 | 0 | 115.3 | ||
| 39 | A | 29.4 | Very low | 31.5 | Very low | 103 Ų | 103 | 136.5 Ų | 136.5 | 85% | 0.851 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 126 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 40 | T | 31.4 | Very low | 32.4 | Very low | 133 Ų | 133 | 134.6 Ų | 134.6 | 82% | 0.816 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -100.5 | 125.7 | 154 | 37.8 | 0 | 0 | 0 | 0 | 108.1 | S42 | T40-S42 PolarHBondContact O-N 3.09Š|
| 41 | T | 32.4 | Very low | 33.7 | Very low | 148 Ų | 148 | 127.7 Ų | 127.7 | 91% | 0.908 | 78% | 0.779 | S | S | * | * | trans | -59.2 | 104.8 | 176.4 | 35.4 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 42 | S | 30.9 | Very low | 35.5 | Very low | 111 Ų | 111 | 125.2 Ų | 125.2 | 78% | 0.776 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -83.6 | 116.8 | 170.5 | 50.3 | 0 | 0 | 0 | 0 | 109.8 | T40 | T40-S42 PolarHBondContact O-N 3.09Š|
| 43 | V | 43.3 | Very low | 37.4 | Very low | 131 Ų | 131 | 123.4 Ų | 123.4 | 79% | 0.794 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 132.7 | 160.1 | 177.3 | 0 | 0 | 0 | 0 | 107 | ||
| 44 | P | 36.4 | Very low | 40.2 | Very low | 102 Ų | 102 | 115.4 Ų | 115.4 | 66% | 0.662 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -64 | 140.6 | -177.9 | 26.5 | -32.7 | 0 | 0 | 0 | 109.3 | S46 | P44-S46 PolarHBondContact O-N 2.84Š|
| 45 | P | 37.1 | Very low | 43.2 | Very low | 122 Ų | 122 | 110.5 Ų | 110.5 | 79% | 0.792 | 70% | 0.697 | S | S | * | * | trans | -65.9 | 114.7 | 174.3 | 27.2 | -30.1 | 0 | 0 | 0 | 107.4 | C47 | P45-C47 PolarHBondContact O-N 3.26Š| ||
| 46 | S | 39.5 | Very low | 46.5 | Very low | 88 Ų | 88 | 107.5 Ų | 107.5 | 62% | 0.615 | 66% | 0.661 | S | S | * | * | trans | -47.2 | 124.6 | 161.7 | 57.2 | 0 | 0 | 0 | 0 | 107.8 | P44 R48 | P44-S46 PolarHBondContact O-N 2.84Å; S46-R48 PolarHBondContact O-N 2.75Å | ||
| 47 | C | 36.8 | Very low | 49.7 | Very low | 135 Ų | 135 | 100.9 Ų | 100.9 | 91% | 0.912 | 63% | 0.629 | S | S | * | * | trans | -45.2 | 97.8 | 173.4 | -84.3 | 0 | 0 | 0 | 0 | 110.3 | P45 C49 | P45-C47 PolarHBondContact O-N 3.26Å; C47-C49 PolarHBondContact O-N 3.05Å | ||
| 48 | R | 32.6 | Very low | 52.7 | Low | 224 Ų | 224 | 95.4 Ų | 95.4 | 85% | 0.845 | 59% | 0.593 | S | S | * | * | trans | -83.3 | 110.1 | 174.2 | -77.4 | -176.4 | 179.2 | -174.8 | 0.7 | 106.9 | S46 | S46-R48 PolarHBondContact O-N 2.75Š| ||
| 49 | C | 34.5 | Very low | 55.9 | Low | 109 Ų | 109 | 88.7 Ų | 88.7 | 74% | 0.736 | 55% | 0.552 | S | S | * | * | trans | -51 | 138.3 | 158.2 | -70.7 | 0 | 0 | 0 | 0 | 108.6 | C47 V51 | C47-C49 PolarHBondContact O-N 3.05Å; C49-V51 PolarHBondContact O-N 3.06Å | ||
| 50 | P | 46.4 | Very low | 59.1 | Low | 132 Ų | 132 | 86.5 Ų | 86.5 | 86% | 0.857 | 52% | 0.523 | S | S | * | . | S | Bend | trans | -74.2 | 8.7 | -167.7 | -13.3 | 28.9 | 0 | 0 | 0 | 115 | ||
| 51 | V | 51.4 | Low | 62.2 | Low | 61 Ų | 61 | 82.2 Ų | 82.2 | 37% | 0.37 | 50% | 0.495 | S | S | . | . | S | Bend | trans | -134.7 | 112 | 179.7 | -167.3 | 0 | 0 | 0 | 0 | 107.9 | C49 V53 | C49-V51 PolarHBondContact O-N 3.06Å; V51-V53 PolarHBondContact O-N 2.97Å |
| 52 | P | 65.8 | Low | 65.3 | Low | 106 Ų | 106 | 75.1 Ų | 75.1 | 69% | 0.688 | 45% | 0.452 | S | S | * | . | trans | -65.4 | 106.6 | 168.4 | 26.6 | -29.5 | 0 | 0 | 0 | 107.4 | S54 | P52-S54 PolarHBondContact O-N 3.28Š| ||
| 53 | V | 67.1 | Low | 68.4 | Low | 95 Ų | 95 | 70 Ų | 70 | 58% | 0.576 | 42% | 0.415 | S | S | * | . | trans | -53.8 | 127.6 | 172.5 | -178.8 | 0 | 0 | 0 | 0 | 108.2 | V51 P57 | V51-V53 PolarHBondContact O-N 2.97Å; V53-P57 VanDerWaalsContact CG1-CD 3.49Å; V53-P57 HydrophobicContact CG1-CG 3.27Å | ||
| 54 | S | 85.1 | Confident | 71 | Confident | 15 Ų | 15 | 64.8 Ų | 64.8 | 11% | 0.105 | 38% | 0.382 | C | S | . | . | trans | -130.1 | -92.9 | -171.1 | 67.8 | 0 | 0 | 0 | 0 | 112.1 | P52 E56 R211 Y256 | P52-S54 PolarHBondContact O-N 3.28Å; S54-E56 VanDerWaalsContact CA-OE2 3.31Å; S54-E56 WeakPolarHBondContact CA-OE2 3.26Å; S54-E56 PolarHBondContact N-OE2 3.37Å; S54-E56 PolarHBondContact OG-OE1 3.2Å; S54-E56 PolarHBondContact OG-OE2 3.43Å; S54-R211 PolarHBondContact OG-NH2 3.46Å; S54-Y256 WeakPolarHBondContact O-CE1 3.3Å | ||
| 55 | V | 91.9 | Very high | 73.9 | Confident | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 35% | 0.351 | C | S | . | . | S | Bend | trans | -95.7 | -9.4 | 179.1 | -67 | 0 | 0 | 0 | 0 | 113 | V58 L59 L148 C195 Y198 V199 L215 I261 | V55-V58 WeakPolarHBondContact O-CB 3.41Å; V55-V58 PolarHBondContact O-N 3.39Å; V55-V58 VanDerWaalsContact O-N 3.15Å; V55-L59 PolarHBondContact O-N 3.21Å; V55-L148 HydrophobicContact CG1-CD1 3.9Å; V55-C195 HydrophobicContact CB-CB 4.38Å; V55-C195 HydrophobicContact CG2-CB 4.24Å; V55-Y198 HydrophobicContact CB-CD1 4.32Å; V55-Y198 HydrophobicContact CG1-CD1 3.22Å; V55-Y198 HydrophobicContact CG1-CD2 4.41Å; V55-Y198 HydrophobicContact CG1-CE1 3.74Å; V55-Y198 HydrophobicContact CG1-CG 3.6Å; V55-Y198 HydrophobicContact CG2-CD1 4.15Å; V55-V199 HydrophobicContact CG2-CG2 3.6Å; V55-L215 HydrophobicContact CG2-CD2 4.07Å; V55-I261 HydrophobicContact CG1-CD1 3.88Å |
| 56 | E | 94.2 | Very high | 76.6 | Confident | 15 Ų | 15 | 56 Ų | 56 | 7% | 0.07 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -55.7 | -43.3 | -177.7 | -60.3 | 78.3 | -179.5 | 0 | 0 | 112.1 | S54 L59 F60 R211 V214 L215 | S54-E56 VanDerWaalsContact CA-OE2 3.31Å; S54-E56 WeakPolarHBondContact CA-OE2 3.26Å; S54-E56 PolarHBondContact N-OE2 3.37Å; S54-E56 PolarHBondContact OG-OE1 3.2Å; S54-E56 PolarHBondContact OG-OE2 3.43Å; E56-L59 PolarHBondContact O-N 3.24Å; E56-F60 WeakPolarHBondContact O-CB 3.37Å; E56-F60 PolarHBondContact O-N 3.4Å; E56-R211 IonicContact OE1-CZ 3.08Å; E56-R211 IonicContact OE1-NE 3.71Å; E56-R211 IonicContact OE1-NH2 2.68Å; E56-R211 PolarHBondContact OE1-NH2 3.42Å; E56-V214 HydrophobicContact CG-CG1 3.87Å; E56-L215 HydrophobicContact CG-CD2 3.97Å |
| 57 | P | 95.4 | Very high | 79.3 | Confident | 32 Ų | 32 | 52 Ų | 52 | 21% | 0.208 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -69 | -34.3 | 177.2 | -23.7 | 38.4 | 0 | 0 | 0 | 114.1 | V53 F60 L61 Y256 | V53-P57 VanDerWaalsContact CG1-CD 3.49Å; V53-P57 HydrophobicContact CG1-CG 3.27Å; P57-F60 PolarHBondContact O-N 2.84Å; P57-L61 WeakPolarHBondContact O-CB 3.42Å; P57-L61 VanDerWaalsContact O-CG 3.3Å; P57-L61 WeakPolarHBondContact O-CG 3.23Å; P57-L61 PolarHBondContact O-N 3.34Å; P57-Y256 HydrophobicContact CB-CD1 4.17Å; P57-Y256 HydrophobicContact CB-CD2 4.43Å; P57-Y256 HydrophobicContact CB-CE1 3.87Å; P57-Y256 HydrophobicContact CB-CE2 4.16Å; P57-Y256 HydrophobicContact CB-CG 4.45Å; P57-Y256 HydrophobicContact CG-CE1 3.89Å; P57-Y256 HydrophobicContact CG-CE2 4.17Å |
| 58 | V | 95.9 | Very high | 82.1 | Confident | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -61.8 | -52 | 175.3 | 175.5 | 0 | 0 | 0 | 0 | 109.1 | V55 F60 L61 S62 V191 S253 Y256 A257 I261 | V55-V58 WeakPolarHBondContact O-CB 3.41Å; V55-V58 PolarHBondContact O-N 3.39Å; V55-V58 VanDerWaalsContact O-N 3.15Å; V58-F60 VanDerWaalsContact C-N 3.31Å; V58-F60 PolarHBondContact O-N 3.04Å; V58-L61 PolarHBondContact O-N 3.49Å; V58-S62 WeakPolarHBondContact O-CB 3.23Å; V58-S62 PolarHBondContact O-N 3.49Å; V58-S62 PolarHBondContact O-OG 3.13Å; V58-V191 HydrophobicContact CG1-CG1 4.03Å; V58-S253 WeakPolarHBondContact CA-OG 3.21Å; V58-S253 WeakPolarHBondContact CG1-OG 3.22Å; V58-S253 PolarHBondContact O-OG 3.26Å; V58-Y256 HydrophobicContact CG2-CD1 3.59Å; V58-Y256 HydrophobicContact CG2-CE1 4.23Å; V58-A257 HydrophobicContact CG2-CB 3.91Å; V58-I261 HydrophobicContact CG2-CD1 3.56Å |
| 59 | L | 95.4 | Very high | 85.1 | Confident | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -60.1 | -43.3 | 179.6 | -171.3 | 64.1 | 0 | 0 | 0 | 111.7 | V55 E56 M63 F188 L192 C195 L215 L219 | V55-L59 PolarHBondContact O-N 3.21Å; E56-L59 PolarHBondContact O-N 3.24Å; L59-M63 VanDerWaalsContact O-CB 3.22Å; L59-M63 WeakPolarHBondContact O-CB 3.07Å; L59-M63 PolarHBondContact O-N 3.33Å; L59-F188 HydrophobicContact CD1-CE2 4.36Å; L59-F188 HydrophobicContact CD1-CZ 4.24Å; L59-L192 HydrophobicContact CD1-CD1 3.82Å; L59-C195 HydrophobicContact CD1-CB 4.4Å; L59-L215 HydrophobicContact CD2-CB 3.66Å; L59-L215 HydrophobicContact CD2-CD2 3.73Å; L59-L215 HydrophobicContact CD2-CG 4.14Å; L59-L219 HydrophobicContact CD1-CD2 3.82Å; L59-L219 HydrophobicContact CD2-CD2 4.02Å; L59-L219 HydrophobicContact CD2-CG 4.11Å; L59-L219 HydrophobicContact CG-CD2 3.8Å; L59-L219 HydrophobicContact CG-CG 4.41Å |
| 60 | F | 97.1 | Very high | 87.8 | Confident | 58 Ų | 58 | 32.2 Ų | 32.2 | 25% | 0.254 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -60.6 | -49.5 | 178.7 | -174.9 | -82.1 | 0 | 0 | 0 | 112 | E56 P57 V58 F64 C218 I221 S222 L225 | E56-F60 WeakPolarHBondContact O-CB 3.37Å; E56-F60 PolarHBondContact O-N 3.4Å; P57-F60 PolarHBondContact O-N 2.84Å; V58-F60 VanDerWaalsContact C-N 3.31Å; V58-F60 PolarHBondContact O-N 3.04Å; F60-F64 WeakPolarHBondContact O-CB 3.18Å; F60-F64 PolarHBondContact O-N 2.9Å; F60-C218 HydrophobicContact CB-CB 4.39Å; F60-C218 HydrophobicContact CD2-CB 4.3Å; F60-I221 HydrophobicContact CE2-CB 4.4Å; F60-I221 HydrophobicContact CE2-CG2 4.07Å; F60-S222 VanDerWaalsContact O-CB 3.31Å; F60-S222 WeakPolarHBondContact O-CB 3.26Å; F60-L225 HydrophobicContact CZ-CD1 4.15Å |
| 61 | L | 97.6 | Very high | 90.1 | Very high | 42 Ų | 42 | 26.8 Ų | 26.8 | 22% | 0.22 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -67.9 | -43 | -178 | -70.8 | 174.1 | 0 | 0 | 0 | 112.1 | P57 V58 F64 S65 T249 A252 | P57-L61 WeakPolarHBondContact O-CB 3.42Å; P57-L61 VanDerWaalsContact O-CG 3.3Å; P57-L61 WeakPolarHBondContact O-CG 3.23Å; P57-L61 PolarHBondContact O-N 3.34Å; V58-L61 PolarHBondContact O-N 3.49Å; L61-F64 WeakPolarHBondContact O-CB 3.35Å; L61-F64 PolarHBondContact O-N 2.86Å; L61-S65 PolarHBondContact O-N 3.34Å; L61-T249 HydrophobicContact CD2-CG2 4.37Å; L61-A252 HydrophobicContact CD1-CB 4.27Å |
| 62 | S | 96.8 | Very high | 92.2 | Very high | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -65.4 | -41.9 | 178.3 | -52.9 | 0 | 0 | 0 | 0 | 111.7 | V58 S65 L66 N152 S253 | V58-S62 WeakPolarHBondContact O-CB 3.23Å; V58-S62 PolarHBondContact O-N 3.49Å; V58-S62 PolarHBondContact O-OG 3.13Å; S62-S65 WeakPolarHBondContact O-CB 3.33Å; S62-S65 PolarHBondContact O-N 3.02Å; S62-L66 PolarHBondContact O-N 2.97Å; S62-N152 PolarHBondContact OG-ND2 3.48Å; S62-N152 PolarHBondContact OG-OD1 3.05Å; S62-S253 PolarHBondContact OG-OG 3.13Å |
| 63 | M | 95.9 | Very high | 93.6 | Very high | 4 Ų | 4 | 19.4 Ų | 19.4 | 2% | 0.02 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -69.1 | -38.8 | 175.8 | 179.1 | 60.7 | -179.2 | 0 | 0 | 111.8 | L59 S65 L66 A67 F188 L219 S222 | L59-M63 VanDerWaalsContact O-CB 3.22Å; L59-M63 WeakPolarHBondContact O-CB 3.07Å; L59-M63 PolarHBondContact O-N 3.33Å; M63-S65 VanDerWaalsContact C-N 3.3Å; M63-S65 PolarHBondContact O-N 2.95Å; M63-L66 PolarHBondContact O-N 3.38Å; M63-L66 HydrophobicContact SD-CD2 4.4Å; M63-A67 HydrophobicContact CE-CB 4.33Å; M63-A67 VanDerWaalsContact O-CB 3.28Å; M63-A67 WeakPolarHBondContact O-CB 3.45Å; M63-A67 PolarHBondContact O-N 2.87Å; M63-F188 HydrophobicContact CB-CE2 3.92Å; M63-F188 HydrophobicContact CB-CZ 4.02Å; M63-F188 HydrophobicContact CG-CZ 4.46Å; M63-F188 HydrophobicContact SD-CE1 4.35Å; M63-F188 HydrophobicContact SD-CE2 4.43Å; M63-F188 HydrophobicContact SD-CZ 3.91Å; M63-L219 HydrophobicContact CB-CD2 3.82Å; M63-L219 HydrophobicContact CG-CB 4.45Å; M63-L219 HydrophobicContact CG-CD2 3.76Å; M63-L219 HydrophobicContact SD-CD2 4.19Å; M63-S222 WeakPolarHBondContact CB-OG 3.17Å; M63-S222 WeakPolarHBondContact CG-OG 3.39Å |
| 64 | F | 97.7 | Very high | 94.9 | Very high | 21 Ų | 21 | 15.5 Ų | 15.5 | 9% | 0.092 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -56.4 | -47.1 | 173.1 | -176.1 | -84.2 | 0 | 0 | 0 | 110.7 | F60 L61 L68 L225 A226 I229 L245 T249 | F60-F64 WeakPolarHBondContact O-CB 3.18Å; F60-F64 PolarHBondContact O-N 2.9Å; L61-F64 WeakPolarHBondContact O-CB 3.35Å; L61-F64 PolarHBondContact O-N 2.86Å; F64-L68 HydrophobicContact CE1-CD2 4.01Å; F64-L68 VanDerWaalsContact O-CB 3.23Å; F64-L68 WeakPolarHBondContact O-CB 3.32Å; F64-L68 PolarHBondContact O-N 3.11Å; F64-L225 HydrophobicContact CD2-CB 4.49Å; F64-L225 HydrophobicContact CE2-CB 4.13Å; F64-A226 HydrophobicContact CD1-CB 4.39Å; F64-A226 HydrophobicContact CD2-CB 3.69Å; F64-A226 HydrophobicContact CE2-CB 3.83Å; F64-A226 HydrophobicContact CG-CB 3.99Å; F64-A226 HydrophobicContact CZ-CB 4.24Å; F64-A226 VanDerWaalsContact O-CB 3.26Å; F64-A226 WeakPolarHBondContact O-CB 3.43Å; F64-I229 HydrophobicContact CE2-CD1 4.04Å; F64-I229 HydrophobicContact CZ-CD1 3.98Å; F64-L245 HydrophobicContact CE1-CD2 3.81Å; F64-L245 HydrophobicContact CE1-CG 4.23Å; F64-L245 HydrophobicContact CZ-CD2 4.24Å; F64-T249 HydrophobicContact CD1-CG2 4.07Å; F64-T249 HydrophobicContact CE1-CG2 4.4Å |
| 65 | S | 97.3 | Very high | 95.3 | Very high | 1 Ų | 1 | 14.9 Ų | 14.9 | 1% | 0.007 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -58.5 | -49.7 | 175.8 | 178.9 | 0 | 0 | 0 | 0 | 112.1 | L61 S62 M63 L68 Q69 V246 N250 | L61-S65 PolarHBondContact O-N 3.34Å; S62-S65 WeakPolarHBondContact O-CB 3.33Å; S62-S65 PolarHBondContact O-N 3.02Å; M63-S65 VanDerWaalsContact C-N 3.3Å; M63-S65 PolarHBondContact O-N 2.95Å; S65-L68 PolarHBondContact O-N 3.48Å; S65-Q69 VanDerWaalsContact O-CB 3.3Å; S65-Q69 WeakPolarHBondContact O-CB 3.19Å; S65-Q69 PolarHBondContact O-N 2.85Å; S65-V246 WeakPolarHBondContact OG-CG1 3.36Å; S65-V246 PolarHBondContact OG-O 2.87Å; S65-N250 WeakPolarHBondContact CB-OD1 3.41Å; S65-N250 PolarHBondContact OG-ND2 3.34Å; S65-N250 PolarHBondContact OG-OD1 2.99Å |
| 66 | L | 95 | Very high | 95.4 | Very high | 39 Ų | 39 | 15.6 Ų | 15.6 | 20% | 0.204 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -62.8 | -45.6 | -177.9 | -179.6 | 65.5 | 0 | 0 | 0 | 111.7 | S62 M63 L68 Q69 A70 F188 | S62-L66 PolarHBondContact O-N 2.97Å; M63-L66 PolarHBondContact O-N 3.38Å; M63-L66 HydrophobicContact SD-CD2 4.4Å; L66-L68 VanDerWaalsContact C-N 3.32Å; L66-L68 PolarHBondContact O-N 2.7Å; L66-Q69 PolarHBondContact O-N 2.92Å; L66-A70 WeakPolarHBondContact O-CB 3.35Å; L66-A70 PolarHBondContact O-N 3.38Å; L66-F188 HydrophobicContact CD2-CB 3.93Å; L66-F188 HydrophobicContact CD2-CD1 3.65Å; L66-F188 HydrophobicContact CD2-CD2 4.15Å; L66-F188 HydrophobicContact CD2-CE1 4.18Å; L66-F188 HydrophobicContact CD2-CG 3.63Å |
| 67 | A | 95.6 | Very high | 95.5 | Very high | 2 Ų | 2 | 14.9 Ų | 14.9 | 2% | 0.017 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -69.9 | -28.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113 | M63 P71 A226 | M63-A67 HydrophobicContact CE-CB 4.33Å; M63-A67 VanDerWaalsContact O-CB 3.28Å; M63-A67 WeakPolarHBondContact O-CB 3.45Å; M63-A67 PolarHBondContact O-N 2.87Å; A67-P71 WeakPolarHBondContact O-CD 3.35Å; A67-A226 HydrophobicContact CB-CB 3.79Å |
| 68 | L | 95.8 | Very high | 95.3 | Very high | 2 Ų | 2 | 13.7 Ų | 13.7 | 1% | 0.01 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -70.7 | -46.2 | 171.7 | -178.9 | 57.8 | 0 | 0 | 0 | 110.6 | F64 S65 L66 L72 A226 P242 L245 V246 | F64-L68 HydrophobicContact CE1-CD2 4.01Å; F64-L68 VanDerWaalsContact O-CB 3.23Å; F64-L68 WeakPolarHBondContact O-CB 3.32Å; F64-L68 PolarHBondContact O-N 3.11Å; S65-L68 PolarHBondContact O-N 3.48Å; L66-L68 VanDerWaalsContact C-N 3.32Å; L66-L68 PolarHBondContact O-N 2.7Å; L68-L72 HydrophobicContact CD1-CD1 3.96Å; L68-L72 HydrophobicContact CG-CD1 4.27Å; L68-L72 VanDerWaalsContact O-CD1 3.25Å; L68-L72 WeakPolarHBondContact O-CD1 3.45Å; L68-L72 WeakPolarHBondContact O-CG 3.44Å; L68-A226 HydrophobicContact CB-CB 4.07Å; L68-P242 HydrophobicContact CD1-CB 4.44Å; L68-L245 HydrophobicContact CD2-CB 4.14Å; L68-L245 HydrophobicContact CD2-CD2 3.87Å; L68-L245 HydrophobicContact CD2-CG 4.08Å; L68-V246 HydrophobicContact CB-CG2 4.15Å; L68-V246 HydrophobicContact CD2-CG2 3.78Å; L68-V246 HydrophobicContact CG-CG2 3.9Å |
| 69 | Q | 94.9 | Very high | 95.2 | Very high | 8 Ų | 8 | 15.2 Ų | 15.2 | 4% | 0.037 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -71.4 | -40.3 | -175.1 | 171.5 | 173.4 | -9.3 | 0 | 0 | 114 | S65 L66 L72 T73 F243 V246 | S65-Q69 VanDerWaalsContact O-CB 3.3Å; S65-Q69 WeakPolarHBondContact O-CB 3.19Å; S65-Q69 PolarHBondContact O-N 2.85Å; L66-Q69 PolarHBondContact O-N 2.92Å; Q69-L72 PolarHBondContact O-N 2.93Å; Q69-T73 WeakPolarHBondContact CG-OG1 3.37Å; Q69-T73 WeakPolarHBondContact O-CB 3.24Å; Q69-T73 PolarHBondContact O-N 2.69Å; Q69-T73 PolarHBondContact O-OG1 3.07Å; Q69-F243 HydrophobicContact CB-CE1 4.42Å; Q69-F243 HydrophobicContact CG-CE1 3.74Å; Q69-F243 HydrophobicContact CG-CZ 4.09Å; Q69-V246 HydrophobicContact CB-CG1 4.24Å; Q69-V246 HydrophobicContact CB-CG2 4.04Å |
| 70 | A | 92.3 | Very high | 95 | Very high | 44 Ų | 44 | 17 Ų | 17 | 36% | 0.364 | 9% | 0.09 | S | C | . | . | H | α-helix | trans | -61.9 | -52.1 | -167.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | L66 L72 T73 T74 | L66-A70 WeakPolarHBondContact O-CB 3.35Å; L66-A70 PolarHBondContact O-N 3.38Å; A70-L72 VanDerWaalsContact C-N 3.32Å; A70-L72 PolarHBondContact O-N 3.23Å; A70-T73 PolarHBondContact O-N 2.74Å; A70-T74 PolarHBondContact O-N 3.24Å |
| 71 | P | 94.4 | Very high | 94.8 | Very high | 17 Ų | 17 | 14.5 Ų | 14.5 | 11% | 0.11 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -66 | -35.4 | 177 | -19.7 | 33.3 | 0 | 0 | 0 | 112.6 | A67 T74 Q75 V328 I343 | A67-P71 WeakPolarHBondContact O-CD 3.35Å; P71-T74 PolarHBondContact O-N 3.39Å; P71-Q75 VanDerWaalsContact C-NE2 3.28Å; P71-Q75 WeakPolarHBondContact O-CB 3.11Å; P71-Q75 VanDerWaalsContact O-CG 3.27Å; P71-Q75 WeakPolarHBondContact O-CG 3.46Å; P71-Q75 PolarHBondContact O-N 3.18Å; P71-Q75 PolarHBondContact O-NE2 3.42Å; P71-V328 HydrophobicContact CB-CG2 3.95Å; P71-V328 HydrophobicContact CG-CG2 4.48Å; P71-I343 HydrophobicContact CB-CG2 4.21Å |
| 72 | L | 94.9 | Very high | 94.5 | Very high | 2 Ų | 2 | 12.6 Ų | 12.6 | 1% | 0.01 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -68.7 | -35.6 | -178.3 | -66.7 | -179.5 | 0 | 0 | 0 | 112.3 | L68 Q69 A70 Y76 R234 P242 F243 | L68-L72 HydrophobicContact CD1-CD1 3.96Å; L68-L72 HydrophobicContact CG-CD1 4.27Å; L68-L72 VanDerWaalsContact O-CD1 3.25Å; L68-L72 WeakPolarHBondContact O-CD1 3.45Å; L68-L72 WeakPolarHBondContact O-CG 3.44Å; Q69-L72 PolarHBondContact O-N 2.93Å; A70-L72 VanDerWaalsContact C-N 3.32Å; A70-L72 PolarHBondContact O-N 3.23Å; L72-Y76 WeakPolarHBondContact O-CB 3.38Å; L72-Y76 PolarHBondContact O-N 3.38Å; L72-R234 HydrophobicContact CD2-CB 3.71Å; L72-R234 HydrophobicContact CD2-CG 4.21Å; L72-P242 HydrophobicContact CD1-CB 3.41Å; L72-P242 VanDerWaalsContact CD1-CB 3.41Å; L72-P242 HydrophobicContact CD1-CG 4.12Å; L72-F243 HydrophobicContact CB-CE2 3.86Å; L72-F243 HydrophobicContact CB-CZ 4.32Å; L72-F243 HydrophobicContact CD1-CE2 4.48Å |
| 73 | T | 94.7 | Very high | 94.1 | Very high | 10 Ų | 10 | 17.2 Ų | 17.2 | 6% | 0.061 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -64.2 | -49.3 | 175.9 | -54.2 | 0 | 0 | 0 | 0 | 110.2 | Q69 A70 Q75 Y76 L77 Y162 | Q69-T73 WeakPolarHBondContact CG-OG1 3.37Å; Q69-T73 WeakPolarHBondContact O-CB 3.24Å; Q69-T73 PolarHBondContact O-N 2.69Å; Q69-T73 PolarHBondContact O-OG1 3.07Å; A70-T73 PolarHBondContact O-N 2.74Å; T73-Q75 VanDerWaalsContact C-N 3.35Å; T73-Q75 PolarHBondContact O-N 3.27Å; T73-Y76 PolarHBondContact O-N 3.27Å; T73-L77 HydrophobicContact CG2-CD1 4.34Å; T73-L77 WeakPolarHBondContact O-CG 3.5Å; T73-L77 PolarHBondContact O-N 3.01Å; T73-Y162 HydrophobicContact CG2-CE2 3.8Å |
| 74 | T | 94.6 | Very high | 93.9 | Very high | 13 Ų | 13 | 22.6 Ų | 22.6 | 8% | 0.08 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -60.9 | -42.9 | 177.8 | -58.2 | 0 | 0 | 0 | 0 | 112 | A70 P71 Y76 L77 W78 T113 N117 V328 L329 L332 | A70-T74 PolarHBondContact O-N 3.24Å; P71-T74 PolarHBondContact O-N 3.39Å; T74-Y76 PolarHBondContact O-N 3.27Å; T74-L77 PolarHBondContact O-N 2.85Å; T74-W78 WeakPolarHBondContact O-CB 3.31Å; T74-W78 PolarHBondContact O-N 2.84Å; T74-T113 HydrophobicContact CG2-CG2 4.31Å; T74-N117 PolarHBondContact OG1-ND2 3.45Å; T74-V328 HydrophobicContact CG2-CB 4.1Å; T74-V328 HydrophobicContact CG2-CG1 3.8Å; T74-L329 HydrophobicContact CG2-CB 4.49Å; T74-L332 HydrophobicContact CG2-CD1 4.5Å |
| 75 | Q | 93.8 | Very high | 93.5 | Very high | 2 Ų | 2 | 24.2 Ų | 24.2 | 1% | 0.009 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -62.8 | -40.4 | 175.8 | -74.4 | 169 | 88.4 | 0 | 0 | 112.2 | P71 T73 W78 D79 R234 Y239 V328 L332 I343 | P71-Q75 VanDerWaalsContact C-NE2 3.28Å; P71-Q75 WeakPolarHBondContact O-CB 3.11Å; P71-Q75 VanDerWaalsContact O-CG 3.27Å; P71-Q75 WeakPolarHBondContact O-CG 3.46Å; P71-Q75 PolarHBondContact O-N 3.18Å; P71-Q75 PolarHBondContact O-NE2 3.42Å; T73-Q75 VanDerWaalsContact C-N 3.35Å; T73-Q75 PolarHBondContact O-N 3.27Å; Q75-W78 PolarHBondContact O-N 3.19Å; Q75-D79 PolarHBondContact O-N 2.68Å; Q75-R234 VanDerWaalsContact OE1-CZ 3.29Å; Q75-Y239 VanDerWaalsContact C-OH 3.23Å; Q75-Y239 HydrophobicContact CB-CE1 3.94Å; Q75-Y239 PolarHBondContact O-OH 2.78Å; Q75-Y239 VanDerWaalsContact O-OH 3.1Å; Q75-V328 HydrophobicContact CG-CG1 4.02Å; Q75-L332 HydrophobicContact CG-CD1 3.99Å; Q75-L332 HydrophobicContact CG-CD2 4.24Å; Q75-L332 HydrophobicContact CG-CG 4.49Å; Q75-I343 HydrophobicContact CG-CD1 3.98Å |
| 76 | Y | 94.7 | Very high | 92.9 | Very high | 16 Ų | 16 | 26.7 Ų | 26.7 | 6% | 0.063 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -65.2 | -43.9 | 176.3 | -178.6 | -94.1 | 0 | 0 | 0 | 111.9 | L72 T73 T74 W78 D79 R80 M166 F175 Y239 | L72-Y76 WeakPolarHBondContact O-CB 3.38Å; L72-Y76 PolarHBondContact O-N 3.38Å; T73-Y76 PolarHBondContact O-N 3.27Å; T74-Y76 PolarHBondContact O-N 3.27Å; Y76-W78 VanDerWaalsContact C-N 3.34Å; Y76-W78 PolarHBondContact O-N 2.84Å; Y76-D79 PolarHBondContact O-N 3.05Å; Y76-R80 HydrophobicContact CD1-CG 3.89Å; Y76-R80 HydrophobicContact CD2-CG 4.34Å; Y76-R80 HydrophobicContact CE1-CG 3.43Å; Y76-R80 VanDerWaalsContact CE1-CG 3.43Å; Y76-R80 HydrophobicContact CE2-CG 3.92Å; Y76-R80 HydrophobicContact CG-CG 4.33Å; Y76-R80 VanDerWaalsContact CZ-CG 3.44Å; Y76-R80 VanDerWaalsContact O-CG 3.29Å; Y76-R80 WeakPolarHBondContact O-CG 3.17Å; Y76-R80 PolarHBondContact O-N 2.72Å; Y76-R80 WeakPolarHBondContact OH-CD 3.42Å; Y76-R80 PolarHBondContact OH-NE 3.34Å; Y76-M166 HydrophobicContact CD1-CE 4.29Å; Y76-M166 HydrophobicContact CD2-CE 4.23Å; Y76-M166 HydrophobicContact CD2-CG 4.27Å; Y76-M166 HydrophobicContact CD2-SD 4.47Å; Y76-M166 HydrophobicContact CE1-CG 4.25Å; Y76-M166 HydrophobicContact CE2-CB 4.45Å; Y76-M166 HydrophobicContact CE2-CG 3.8Å; Y76-M166 HydrophobicContact CG-CE 4.04Å; Y76-F175 AromaticContact CD1-CE2 3.69Å; Y76-F175 HydrophobicContact CD1-CE2 3.69Å; Y76-F175 AromaticContact CD1-CZ 3.5Å; Y76-F175 HydrophobicContact CD1-CZ 3.5Å; Y76-F175 VanDerWaalsContact CD1-CZ 3.5Å; Y76-F175 AromaticContact CE1-CE2 3.58Å; Y76-F175 HydrophobicContact CE1-CE2 3.58Å; Y76-F175 AromaticContact CE1-CZ 3.46Å; Y76-F175 HydrophobicContact CE1-CZ 3.46Å; Y76-F175 VanDerWaalsContact CE1-CZ 3.46Å; Y76-Y239 HydrophobicContact CD2-CD1 4.38Å; Y76-Y239 AromaticContact CD2-CD2 3.72Å; Y76-Y239 HydrophobicContact CD2-CD2 3.72Å; Y76-Y239 HydrophobicContact CD2-CE2 4.01Å; Y76-Y239 AromaticContact CD2-CG 3.89Å; Y76-Y239 HydrophobicContact CD2-CG 3.89Å; Y76-Y239 HydrophobicContact CE2-CD2 4.45Å; Y76-Y239 PolarHBondContact N-OH 2.94Å |
| 77 | L | 94.8 | Very high | 92.3 | Very high | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -58.9 | -47.8 | 176.3 | -70 | 175.3 | 0 | 0 | 0 | 111.2 | T73 T74 D79 R80 I81 T113 W116 N117 I120 V172 F175 | T73-L77 HydrophobicContact CG2-CD1 4.34Å; T73-L77 WeakPolarHBondContact O-CG 3.5Å; T73-L77 PolarHBondContact O-N 3.01Å; T74-L77 PolarHBondContact O-N 2.85Å; L77-D79 PolarHBondContact O-N 3.37Å; L77-R80 PolarHBondContact O-N 2.64Å; L77-I81 WeakPolarHBondContact O-CB 3.43Å; L77-I81 WeakPolarHBondContact O-CD1 3.45Å; L77-I81 WeakPolarHBondContact O-CG1 3.25Å; L77-I81 PolarHBondContact O-N 3.01Å; L77-T113 HydrophobicContact CB-CG2 4.13Å; L77-W116 HydrophobicContact CD1-CB 4.41Å; L77-N117 VanDerWaalsContact CD1-OD1 3.26Å; L77-N117 WeakPolarHBondContact CD1-OD1 3.47Å; L77-I120 HydrophobicContact CD1-CD1 3.94Å; L77-I120 HydrophobicContact CD2-CD1 4.23Å; L77-V172 HydrophobicContact CD2-CB 4.3Å; L77-V172 HydrophobicContact CD2-CG1 3.26Å; L77-V172 HydrophobicContact CD2-CG2 4.11Å; L77-F175 HydrophobicContact CD2-CD2 3.99Å; L77-F175 HydrophobicContact CD2-CE2 4.09Å |
| 78 | W | 93 | Very high | 91 | Very high | 7 Ų | 7 | 31 Ų | 31 | 3% | 0.027 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -54.3 | -51.6 | 175.4 | 177.5 | -84.2 | 0 | 0 | 0 | 111.9 | T74 Q75 Y76 R80 S82 Y87 Q106 V109 E110 T113 L329 L332 S333 | T74-W78 WeakPolarHBondContact O-CB 3.31Å; T74-W78 PolarHBondContact O-N 2.84Å; Q75-W78 PolarHBondContact O-N 3.19Å; Y76-W78 VanDerWaalsContact C-N 3.34Å; Y76-W78 PolarHBondContact O-N 2.84Å; W78-R80 PolarHBondContact O-N 3.17Å; W78-S82 VanDerWaalsContact O-CB 3.27Å; W78-S82 WeakPolarHBondContact O-CB 3.37Å; W78-S82 PolarHBondContact O-N 3.42Å; W78-S82 PolarHBondContact O-OG 3.41Å; W78-Y87 HydrophobicContact CZ2-CE1 4.34Å; W78-Q106 HydrophobicContact CH2-CG 4.17Å; W78-Q106 HydrophobicContact CZ2-CG 4.43Å; W78-V109 HydrophobicContact CD2-CG1 3.75Å; W78-V109 HydrophobicContact CE3-CG1 3.73Å; W78-V109 HydrophobicContact CG-CG1 4.39Å; W78-V109 HydrophobicContact CH2-CG1 4.07Å; W78-V109 HydrophobicContact CZ2-CG1 4.07Å; W78-V109 HydrophobicContact CZ3-CG1 3.89Å; W78-E110 HydrophobicContact CH2-CG 3.6Å; W78-E110 HydrophobicContact CZ3-CB 4.28Å; W78-E110 HydrophobicContact CZ3-CG 3.45Å; W78-E110 VanDerWaalsContact CZ3-CG 3.45Å; W78-T113 HydrophobicContact CB-CG2 4.47Å; W78-L329 HydrophobicContact CE3-CD1 3.6Å; W78-L329 HydrophobicContact CZ3-CD1 3.64Å; W78-L332 HydrophobicContact CB-CD1 3.95Å; W78-L332 HydrophobicContact CD2-CB 4.24Å; W78-L332 HydrophobicContact CD2-CD1 4.27Å; W78-L332 HydrophobicContact CE3-CB 4.38Å; W78-L332 HydrophobicContact CG-CD1 4.01Å; W78-S333 WeakPolarHBondContact CH2-OG 3.32Å; W78-S333 VanDerWaalsContact CZ3-OG 3.23Å; W78-S333 WeakPolarHBondContact CZ3-OG 3.08Å |
| 79 | D | 92.1 | Very high | 89.5 | Confident | 32 Ų | 32 | 32.2 Ų | 32.2 | 17% | 0.171 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -64.8 | -41.5 | -177.8 | -75.4 | -11.2 | 0 | 0 | 0 | 111.8 | Q75 Y76 L77 S82 E83 R234 Y239 | Q75-D79 PolarHBondContact O-N 2.68Å; Y76-D79 PolarHBondContact O-N 3.05Å; L77-D79 PolarHBondContact O-N 3.37Å; D79-S82 WeakPolarHBondContact O-CB 3.49Å; D79-S82 PolarHBondContact O-N 2.73Å; D79-E83 WeakPolarHBondContact O-CG 3.42Å; D79-E83 PolarHBondContact O-N 3.28Å; D79-R234 IonicContact OD1-NH2 2.96Å; D79-R234 IonicContact OD2-CZ 2.62Å; D79-R234 IonicContact OD2-NH2 3.8Å; D79-R234 PolarHBondContact OD2-NH2 3.42Å; D79-Y239 PolarHBondContact OD2-OH 3.33Å |
| 80 | R | 91.9 | Very high | 87.5 | Confident | 36 Ų | 36 | 34.8 Ų | 34.8 | 14% | 0.136 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -68.2 | -43 | 179.4 | -67.1 | -66 | -79.2 | 135 | 6.9 | 112.5 | Y76 L77 W78 S82 E83 D84 K169 | Y76-R80 HydrophobicContact CD1-CG 3.89Å; Y76-R80 HydrophobicContact CD2-CG 4.34Å; Y76-R80 HydrophobicContact CE1-CG 3.43Å; Y76-R80 VanDerWaalsContact CE1-CG 3.43Å; Y76-R80 HydrophobicContact CE2-CG 3.92Å; Y76-R80 HydrophobicContact CG-CG 4.33Å; Y76-R80 VanDerWaalsContact CZ-CG 3.44Å; Y76-R80 VanDerWaalsContact O-CG 3.29Å; Y76-R80 WeakPolarHBondContact O-CG 3.17Å; Y76-R80 PolarHBondContact O-N 2.72Å; Y76-R80 WeakPolarHBondContact OH-CD 3.42Å; Y76-R80 PolarHBondContact OH-NE 3.34Å; L77-R80 PolarHBondContact O-N 2.64Å; W78-R80 PolarHBondContact O-N 3.17Å; R80-S82 VanDerWaalsContact C-N 3.3Å; R80-S82 PolarHBondContact O-N 3.39Å; R80-E83 IonicContact CZ-OE2 3.71Å; R80-E83 IonicContact NH1-OE2 3.82Å; R80-E83 PolarHBondContact NH1-OE2 2.95Å; R80-E83 WeakPolarHBondContact O-CB 3.4Å; R80-E83 PolarHBondContact O-N 3.24Å; R80-D84 VanDerWaalsContact O-CG 3.32Å; R80-D84 PolarHBondContact O-N 2.99Å; R80-K169 PolarHBondContact NH2-O 3.41Å; R80-K169 VanDerWaalsContact NH2-O 3.17Å |
| 81 | I | 92.8 | Very high | 85.5 | Confident | 6 Ų | 6 | 41.7 Ų | 41.7 | 3% | 0.031 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -66.4 | -37.7 | 176.4 | -66.6 | 165.3 | 0 | 0 | 0 | 110.2 | L77 E83 D84 L85 V109 L112 | L77-I81 WeakPolarHBondContact O-CB 3.43Å; L77-I81 WeakPolarHBondContact O-CD1 3.45Å; L77-I81 WeakPolarHBondContact O-CG1 3.25Å; L77-I81 PolarHBondContact O-N 3.01Å; I81-E83 VanDerWaalsContact C-N 3.33Å; I81-E83 PolarHBondContact O-N 3.13Å; I81-D84 PolarHBondContact O-N 3.1Å; I81-L85 HydrophobicContact CG2-CD1 4.09Å; I81-L85 WeakPolarHBondContact O-CB 3.36Å; I81-L85 PolarHBondContact O-N 3.29Å; I81-V109 HydrophobicContact CG2-CB 4.43Å; I81-V109 HydrophobicContact CG2-CG1 4.26Å; I81-V109 HydrophobicContact CG2-CG2 4.34Å; I81-L112 HydrophobicContact CD1-CB 4.16Å; I81-L112 HydrophobicContact CG2-CB 3.87Å; I81-L112 HydrophobicContact CG2-CD1 3.92Å |
| 82 | S | 90.7 | Very high | 83.3 | Confident | 2 Ų | 2 | 50.8 Ų | 50.8 | 1% | 0.014 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61.1 | -42.5 | 173.4 | -60.6 | 0 | 0 | 0 | 0 | 111.6 | W78 D79 R80 G86 Y87 V109 | W78-S82 VanDerWaalsContact O-CB 3.27Å; W78-S82 WeakPolarHBondContact O-CB 3.37Å; W78-S82 PolarHBondContact O-N 3.42Å; W78-S82 PolarHBondContact O-OG 3.41Å; D79-S82 WeakPolarHBondContact O-CB 3.49Å; D79-S82 PolarHBondContact O-N 2.73Å; R80-S82 VanDerWaalsContact C-N 3.3Å; R80-S82 PolarHBondContact O-N 3.39Å; S82-G86 CarbonylContact O-C 3.39Å; S82-G86 PolarHBondContact O-N 3.49Å; S82-Y87 PolarHBondContact O-N 3.1Å; S82-V109 WeakPolarHBondContact OG-CG1 3.31Å |
| 83 | E | 90.3 | Very high | 80.9 | Confident | 98 Ų | 98 | 56.9 Ų | 56.9 | 46% | 0.458 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -61.9 | -45.6 | 174.5 | -74.9 | 178 | 166.7 | 0 | 0 | 111.9 | D79 R80 I81 L85 G86 | D79-E83 WeakPolarHBondContact O-CG 3.42Å; D79-E83 PolarHBondContact O-N 3.28Å; R80-E83 IonicContact CZ-OE2 3.71Å; R80-E83 IonicContact NH1-OE2 3.82Å; R80-E83 PolarHBondContact NH1-OE2 2.95Å; R80-E83 WeakPolarHBondContact O-CB 3.4Å; R80-E83 PolarHBondContact O-N 3.24Å; I81-E83 VanDerWaalsContact C-N 3.33Å; I81-E83 PolarHBondContact O-N 3.13Å; E83-L85 VanDerWaalsContact C-N 3.32Å; E83-L85 PolarHBondContact O-N 3.48Å; E83-G86 PolarHBondContact O-N 3.43Å |
| 84 | D | 90 | Very high | 79 | Confident | 117 Ų | 117 | 58.8 Ų | 58.8 | 63% | 0.626 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -64.8 | -35.3 | -178.7 | -69.3 | -17.4 | 0 | 0 | 0 | 112.3 | R80 I81 | R80-D84 VanDerWaalsContact O-CG 3.32Å; R80-D84 PolarHBondContact O-N 2.99Å; I81-D84 PolarHBondContact O-N 3.1Å |
| 85 | L | 89.4 | Confident | 77.4 | Confident | 54 Ų | 54 | 60.1 Ų | 60.1 | 28% | 0.283 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -88.3 | -4.8 | 176.6 | -67.1 | 178.7 | 0 | 0 | 0 | 114 | I81 E83 Y87 E108 V109 L112 | I81-L85 HydrophobicContact CG2-CD1 4.09Å; I81-L85 WeakPolarHBondContact O-CB 3.36Å; I81-L85 PolarHBondContact O-N 3.29Å; E83-L85 VanDerWaalsContact C-N 3.32Å; E83-L85 PolarHBondContact O-N 3.48Å; L85-Y87 VanDerWaalsContact C-N 3.29Å; L85-Y87 PolarHBondContact O-N 3.3Å; L85-E108 HydrophobicContact CD1-CB 4.18Å; L85-E108 HydrophobicContact CD1-CG 3.84Å; L85-V109 HydrophobicContact CD1-CG2 3.76Å; L85-L112 HydrophobicContact CD1-CD1 3.89Å |
| 86 | G | 84.8 | Confident | 75.4 | Confident | 53 Ų | 53 | 64.5 Ų | 64.5 | 55% | 0.546 | 36% | 0.362 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 69.9 | 20.9 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | S82 E83 N88 | S82-G86 CarbonylContact O-C 3.39Å; S82-G86 PolarHBondContact O-N 3.49Å; E83-G86 PolarHBondContact O-N 3.43Å; G86-N88 PolarHBondContact O-N 2.88Å |
| 87 | Y | 82.4 | Confident | 73.3 | Confident | 23 Ų | 23 | 72.2 Ų | 72.2 | 9% | 0.09 | 40% | 0.404 | C | S | . | . | trans | -77.3 | 112.2 | 178.2 | 179.1 | -111.4 | 0 | 0 | 0 | 111.3 | W78 S82 L85 D103 L105 Q106 V109 | W78-Y87 HydrophobicContact CZ2-CE1 4.34Å; S82-Y87 PolarHBondContact O-N 3.1Å; L85-Y87 VanDerWaalsContact C-N 3.29Å; L85-Y87 PolarHBondContact O-N 3.3Å; Y87-D103 WeakPolarHBondContact CE2-OD2 3.49Å; Y87-L105 HydrophobicContact CD2-CB 4.04Å; Y87-Q106 HydrophobicContact CE1-CB 4.39Å; Y87-Q106 HydrophobicContact CE1-CG 4.18Å; Y87-Q106 HydrophobicContact CE2-CB 3.84Å; Y87-Q106 HydrophobicContact CE2-CG 4.42Å; Y87-Q106 WeakPolarHBondContact OH-CG 3.4Å; Y87-Q106 PolarHBondContact OH-OE1 3.45Å; Y87-Q106 VanDerWaalsContact OH-OE1 3.14Å; Y87-V109 HydrophobicContact CD1-CG2 4.16Å; Y87-V109 HydrophobicContact CG-CG2 4.21Å | ||
| 88 | N | 69.3 | Low | 70.9 | Confident | 108 Ų | 108 | 75.7 Ų | 75.7 | 58% | 0.578 | 43% | 0.429 | S | S | * | . | trans | -93.1 | 1.4 | -177.3 | -88.2 | -36.7 | 0 | 0 | 0 | 114.6 | G86 S90 R91 | G86-N88 PolarHBondContact O-N 2.88Å; N88-S90 PolarHBondContact O-N 3.07Å; N88-S90 VanDerWaalsContact O-N 3.14Å; N88-R91 PolarHBondContact O-N 3.45Å; N88-R91 VanDerWaalsContact O-N 3.1Å | ||
| 89 | G | 62.9 | Low | 68.6 | Low | 29 Ų | 29 | 81.8 Ų | 81.8 | 30% | 0.299 | 47% | 0.472 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | -21 | -173.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 90 | S | 53 | Low | 66.8 | Low | 61 Ų | 61 | 85.7 Ų | 85.7 | 43% | 0.427 | 50% | 0.497 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.1 | -20.7 | 176 | 55.4 | 0 | 0 | 0 | 0 | 114.4 | N88 | N88-S90 PolarHBondContact O-N 3.07Å; N88-S90 VanDerWaalsContact O-N 3.14Å |
| 91 | R | 50.6 | Low | 65 | Low | 190 Ų | 190 | 90.8 Ų | 90.8 | 72% | 0.717 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.6 | -15.7 | -177.8 | -74.3 | -175.4 | 178.8 | 174.6 | 3.3 | 114.1 | N88 | N88-R91 PolarHBondContact O-N 3.45Å; N88-R91 VanDerWaalsContact O-N 3.1Å |
| 92 | R | 49 | Very low | 63.5 | Low | 208 Ų | 208 | 95.3 Ų | 95.3 | 79% | 0.785 | 56% | 0.557 | S | S | * | * | S | Bend | trans | -90.7 | 115.8 | 172.2 | -76.6 | -177.9 | 175.6 | 176.4 | -0.6 | 108.2 | G94 | R92-G94 PolarHBondContact O-N 3.3Š|
| 93 | S | 44.8 | Very low | 62.8 | Low | 130 Ų | 130 | 98.2 Ų | 98.2 | 91% | 0.909 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -53.6 | 104.5 | 173.8 | 52.7 | 0 | 0 | 0 | 0 | 110.6 | ||
| 94 | G | 54.4 | Low | 62.4 | Low | 50 Ų | 50 | 98.3 Ų | 98.3 | 52% | 0.515 | 58% | 0.582 | S | S | . | * | S | Bend | trans | 93.6 | 127.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | R92 S96 | R92-G94 PolarHBondContact O-N 3.3Å; G94-S96 PolarHBondContact O-N 3.28Å |
| 95 | C | 60.6 | Low | 62.2 | Low | 40 Ų | 40 | 96.1 Ų | 96.1 | 27% | 0.27 | 57% | 0.569 | S | S | . | * | trans | -62.9 | 118.8 | 160.8 | -74.3 | 0 | 0 | 0 | 0 | 107.8 | N97 C337 | C95-N97 PolarHBondContact O-N 3.28Å; C95-C337 HydrophobicContact CB-CB 3.82Å; C95-C337 WeakPolarHBondContact CB-SG 3.31Å; C95-C337 WeakPolarHBondContact SG-CB 3.28Å; C95-C337 CovalentContact SG-SG 2.01Å; C95-C337 PolarHBondContact SG-SG 3.33Å | ||
| 96 | S | 52.3 | Low | 62 | Low | 94 Ų | 94 | 94.4 Ų | 94.4 | 66% | 0.657 | 56% | 0.56 | S | S | * | * | trans | -58.4 | 140.5 | -179.6 | 54.2 | 0 | 0 | 0 | 0 | 109.8 | G94 S98 | G94-S96 PolarHBondContact O-N 3.28Å; S96-S98 PolarHBondContact O-N 2.99Å | ||
| 97 | N | 49.5 | Very low | 62.1 | Low | 178 Ų | 178 | 95 Ų | 95 | 95% | 0.952 | 55% | 0.547 | S | S | * | . | S | Bend | trans | -64.4 | 28.7 | 178.5 | -110.2 | 6.6 | 0 | 0 | 0 | 114.6 | C95 | C95-N97 PolarHBondContact O-N 3.28Š|
| 98 | S | 44.6 | Very low | 62.6 | Low | 73 Ų | 73 | 98.1 Ų | 98.1 | 51% | 0.51 | 56% | 0.563 | S | S | . | * | trans | -95 | 126 | -176.5 | -53.9 | 0 | 0 | 0 | 0 | 108.7 | S96 V100 | S96-S98 PolarHBondContact O-N 2.99Å; S98-V100 PolarHBondContact O-N 3.49Å | ||
| 99 | S | 45.3 | Very low | 63.7 | Low | 135 Ų | 135 | 93 Ų | 93 | 94% | 0.944 | 54% | 0.535 | S | S | * | . | trans | -58.9 | 65.3 | 164.7 | 52.8 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 100 | V | 53.4 | Low | 65 | Low | 114 Ų | 114 | 92.1 Ų | 92.1 | 69% | 0.691 | 52% | 0.523 | S | S | * | . | trans | -107.8 | 135 | 179.6 | -178.2 | 0 | 0 | 0 | 0 | 106.6 | S98 | S98-V100 PolarHBondContact O-N 3.49Š| ||
| 101 | D | 55.2 | Low | 66.9 | Low | 143 Ų | 143 | 90.9 Ų | 90.9 | 77% | 0.765 | 51% | 0.513 | S | S | * | . | P | Polyproline II helix | trans | -46.3 | 145.7 | 171.7 | -76.4 | -51.5 | 0 | 0 | 0 | 110.9 | D103 | D101-D103 PolarHBondContact O-N 2.96Š|
| 102 | P | 61.8 | Low | 69 | Low | 101 Ų | 101 | 84.5 Ų | 84.5 | 66% | 0.656 | 49% | 0.493 | S | S | * | . | P | Polyproline II helix | trans | -54.6 | 120.5 | -178.9 | 20.1 | -30.2 | 0 | 0 | 0 | 109.6 | P104 | P102-P104 WeakPolarHBondContact O-CD 3.32Å; P102-P104 VanDerWaalsContact O-N 3.07Å |
| 103 | D | 75.3 | Confident | 71.2 | Confident | 63 Ų | 63 | 74.6 Ų | 74.6 | 34% | 0.337 | 46% | 0.456 | S | S | . | . | P | Polyproline II helix | trans | -53.1 | 118.4 | 178.5 | -177.8 | -12.1 | 0 | 0 | 0 | 108.2 | Y87 D101 L105 Q106 K107 | Y87-D103 WeakPolarHBondContact CE2-OD2 3.49Å; D101-D103 PolarHBondContact O-N 2.96Å; D103-L105 PolarHBondContact O-N 3.08Å; D103-L105 VanDerWaalsContact O-N 3.14Å; D103-L105 WeakPolarHBondContact OD1-CB 3.49Å; D103-L105 PolarHBondContact OD1-N 3.28Å; D103-Q106 HydrophobicContact CB-CB 3.97Å; D103-Q106 WeakPolarHBondContact O-CB 3.5Å; D103-Q106 PolarHBondContact O-N 3.29Å; D103-K107 PolarHBondContact O-N 3.49Å |
| 104 | P | 82.1 | Confident | 73.5 | Confident | 101 Ų | 101 | 68.4 Ų | 68.4 | 66% | 0.656 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -56.8 | -31.8 | -177.5 | 22.4 | -33.7 | 0 | 0 | 0 | 111.8 | P102 K107 E108 | P102-P104 WeakPolarHBondContact O-CD 3.32Å; P102-P104 VanDerWaalsContact O-N 3.07Å; P104-K107 PolarHBondContact O-N 3.39Å; P104-E108 PolarHBondContact O-N 3.05Å |
| 105 | L | 85.4 | Confident | 75.4 | Confident | 70 Ų | 70 | 68.8 Ų | 68.8 | 37% | 0.366 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -69.6 | -40 | 176.4 | -67.9 | 170.7 | 0 | 0 | 0 | 111.9 | Y87 D103 E108 V109 | Y87-L105 HydrophobicContact CD2-CB 4.04Å; D103-L105 PolarHBondContact O-N 3.08Å; D103-L105 VanDerWaalsContact O-N 3.14Å; D103-L105 WeakPolarHBondContact OD1-CB 3.49Å; D103-L105 PolarHBondContact OD1-N 3.28Å; L105-E108 WeakPolarHBondContact O-CB 3.4Å; L105-E108 PolarHBondContact O-N 2.85Å; L105-V109 WeakPolarHBondContact O-CG2 3Å; L105-V109 PolarHBondContact O-N 3.35Å |
| 106 | Q | 85.9 | Confident | 77 | Confident | 18 Ų | 18 | 69.8 Ų | 69.8 | 8% | 0.084 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -64.2 | -43.3 | 175.8 | -169.9 | -167 | -48.6 | 0 | 0 | 110.9 | W78 Y87 D103 E108 V109 E110 S334 | W78-Q106 HydrophobicContact CH2-CG 4.17Å; W78-Q106 HydrophobicContact CZ2-CG 4.43Å; Y87-Q106 HydrophobicContact CE1-CB 4.39Å; Y87-Q106 HydrophobicContact CE1-CG 4.18Å; Y87-Q106 HydrophobicContact CE2-CB 3.84Å; Y87-Q106 HydrophobicContact CE2-CG 4.42Å; Y87-Q106 WeakPolarHBondContact OH-CG 3.4Å; Y87-Q106 PolarHBondContact OH-OE1 3.45Å; Y87-Q106 VanDerWaalsContact OH-OE1 3.14Å; D103-Q106 HydrophobicContact CB-CB 3.97Å; D103-Q106 WeakPolarHBondContact O-CB 3.5Å; D103-Q106 PolarHBondContact O-N 3.29Å; Q106-E108 PolarHBondContact O-N 3.23Å; Q106-V109 PolarHBondContact O-N 3.4Å; Q106-E110 PolarHBondContact NE2-OE1 2.88Å; Q106-E110 WeakPolarHBondContact O-CB 3.5Å; Q106-E110 WeakPolarHBondContact O-CG 3.31Å; Q106-E110 PolarHBondContact O-N 2.82Å; Q106-S334 VanDerWaalsContact NE2-CB 3.27Å |
| 107 | K | 87.3 | Confident | 79 | Confident | 65 Ų | 65 | 65.9 Ų | 65.9 | 28% | 0.283 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -60.6 | -35.7 | 176.3 | -172.6 | 178.2 | 179.1 | -178.5 | 0 | 111.7 | D103 P104 T111 L457 | D103-K107 PolarHBondContact O-N 3.49Å; P104-K107 PolarHBondContact O-N 3.39Å; K107-T111 VanDerWaalsContact O-CB 3.3Å; K107-T111 WeakPolarHBondContact O-CB 3.39Å; K107-T111 PolarHBondContact O-N 3.01Å; K107-T111 PolarHBondContact O-OG1 2.97Å; K107-L457 HydrophobicContact CG-CB 4.41Å; K107-L457 HydrophobicContact CG-CD1 4.02Å |
| 108 | E | 91.3 | Very high | 81.1 | Confident | 90 Ų | 90 | 57.9 Ų | 57.9 | 42% | 0.421 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -68 | -45.8 | 174.4 | -167.5 | 173.4 | -178.1 | 0 | 0 | 111.9 | L85 P104 L105 Q106 E110 T111 L112 | L85-E108 HydrophobicContact CD1-CB 4.18Å; L85-E108 HydrophobicContact CD1-CG 3.84Å; P104-E108 PolarHBondContact O-N 3.05Å; L105-E108 WeakPolarHBondContact O-CB 3.4Å; L105-E108 PolarHBondContact O-N 2.85Å; Q106-E108 PolarHBondContact O-N 3.23Å; E108-E110 VanDerWaalsContact C-N 3.34Å; E108-E110 PolarHBondContact O-N 3.19Å; E108-T111 PolarHBondContact O-N 2.92Å; E108-L112 HydrophobicContact CG-CD1 4.21Å; E108-L112 HydrophobicContact CG-CG 4.49Å; E108-L112 WeakPolarHBondContact O-CB 3.09Å; E108-L112 WeakPolarHBondContact O-CG 3.35Å; E108-L112 PolarHBondContact O-N 3.24Å |
| 109 | V | 92.1 | Very high | 83.5 | Confident | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -58 | -45.7 | 173.6 | 173.8 | 0 | 0 | 0 | 0 | 111.2 | W78 I81 S82 L85 Y87 L105 Q106 T111 L112 T113 | W78-V109 HydrophobicContact CD2-CG1 3.75Å; W78-V109 HydrophobicContact CE3-CG1 3.73Å; W78-V109 HydrophobicContact CG-CG1 4.39Å; W78-V109 HydrophobicContact CH2-CG1 4.07Å; W78-V109 HydrophobicContact CZ2-CG1 4.07Å; W78-V109 HydrophobicContact CZ3-CG1 3.89Å; I81-V109 HydrophobicContact CG2-CB 4.43Å; I81-V109 HydrophobicContact CG2-CG1 4.26Å; I81-V109 HydrophobicContact CG2-CG2 4.34Å; S82-V109 WeakPolarHBondContact OG-CG1 3.31Å; L85-V109 HydrophobicContact CD1-CG2 3.76Å; Y87-V109 HydrophobicContact CD1-CG2 4.16Å; Y87-V109 HydrophobicContact CG-CG2 4.21Å; L105-V109 WeakPolarHBondContact O-CG2 3Å; L105-V109 PolarHBondContact O-N 3.35Å; Q106-V109 PolarHBondContact O-N 3.4Å; V109-T111 VanDerWaalsContact C-N 3.34Å; V109-T111 PolarHBondContact O-N 3.07Å; V109-L112 PolarHBondContact O-N 2.97Å; V109-T113 VanDerWaalsContact O-CB 3.29Å; V109-T113 WeakPolarHBondContact O-CB 3.29Å; V109-T113 PolarHBondContact O-N 3.26Å; V109-T113 PolarHBondContact O-OG1 2.81Å |
| 110 | E | 91.5 | Very high | 85.8 | Confident | 10 Ų | 10 | 53.6 Ų | 53.6 | 5% | 0.047 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -56.6 | -48.9 | 175.5 | -80.2 | 176.8 | -140.6 | 0 | 0 | 111.5 | W78 Q106 E108 T113 A114 S333 L457 | W78-E110 HydrophobicContact CH2-CG 3.6Å; W78-E110 HydrophobicContact CZ3-CB 4.28Å; W78-E110 HydrophobicContact CZ3-CG 3.45Å; W78-E110 VanDerWaalsContact CZ3-CG 3.45Å; Q106-E110 PolarHBondContact NE2-OE1 2.88Å; Q106-E110 WeakPolarHBondContact O-CB 3.5Å; Q106-E110 WeakPolarHBondContact O-CG 3.31Å; Q106-E110 PolarHBondContact O-N 2.82Å; E108-E110 VanDerWaalsContact C-N 3.34Å; E108-E110 PolarHBondContact O-N 3.19Å; E110-T113 PolarHBondContact O-N 3.13Å; E110-A114 WeakPolarHBondContact O-CB 3.35Å; E110-A114 PolarHBondContact O-N 3.13Å; E110-S333 VanDerWaalsContact CD-OG 3.29Å; E110-S333 WeakPolarHBondContact CG-OG 3.13Å; E110-S333 WeakPolarHBondContact OE1-CB 3.17Å; E110-S333 PolarHBondContact OE1-OG 3.35Å; E110-L457 HydrophobicContact CB-CD1 3.96Å; E110-L457 WeakPolarHBondContact OE2-CD2 3.22Å |
| 111 | T | 93 | Very high | 87.6 | Confident | 35 Ų | 35 | 48.2 Ų | 48.2 | 22% | 0.215 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.2 | -47 | -177.5 | -62.2 | 0 | 0 | 0 | 0 | 111.6 | K107 E108 V109 A114 H115 P454 | K107-T111 VanDerWaalsContact O-CB 3.3Å; K107-T111 WeakPolarHBondContact O-CB 3.39Å; K107-T111 PolarHBondContact O-N 3.01Å; K107-T111 PolarHBondContact O-OG1 2.97Å; E108-T111 PolarHBondContact O-N 2.92Å; V109-T111 VanDerWaalsContact C-N 3.34Å; V109-T111 PolarHBondContact O-N 3.07Å; T111-A114 PolarHBondContact O-N 3.38Å; T111-H115 WeakPolarHBondContact CG2-CE1 3.39Å; T111-H115 PolarHBondContact O-N 3.39Å; T111-H115 PolarHBondContact O-ND1 3.43Å; T111-P454 HydrophobicContact CG2-CB 3.77Å |
| 112 | L | 94.1 | Very high | 89.3 | Confident | 56 Ų | 56 | 43.8 Ų | 43.8 | 29% | 0.293 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -66.9 | -37.7 | 178.5 | -70.3 | 177.9 | 0 | 0 | 0 | 111.9 | I81 L85 E108 V109 H115 W116 | I81-L112 HydrophobicContact CD1-CB 4.16Å; I81-L112 HydrophobicContact CG2-CB 3.87Å; I81-L112 HydrophobicContact CG2-CD1 3.92Å; L85-L112 HydrophobicContact CD1-CD1 3.89Å; E108-L112 HydrophobicContact CG-CD1 4.21Å; E108-L112 HydrophobicContact CG-CG 4.49Å; E108-L112 WeakPolarHBondContact O-CB 3.09Å; E108-L112 WeakPolarHBondContact O-CG 3.35Å; E108-L112 PolarHBondContact O-N 3.24Å; V109-L112 PolarHBondContact O-N 2.97Å; L112-H115 PolarHBondContact O-N 3.41Å; L112-W116 VanDerWaalsContact O-CD1 3.27Å; L112-W116 PolarHBondContact O-N 3.2Å |
| 113 | T | 94.5 | Very high | 90.7 | Very high | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -64.7 | -43.2 | 176.1 | -55.6 | 0 | 0 | 0 | 0 | 110.9 | T74 L77 W78 V109 E110 W116 N117 L329 | T74-T113 HydrophobicContact CG2-CG2 4.31Å; L77-T113 HydrophobicContact CB-CG2 4.13Å; W78-T113 HydrophobicContact CB-CG2 4.47Å; V109-T113 VanDerWaalsContact O-CB 3.29Å; V109-T113 WeakPolarHBondContact O-CB 3.29Å; V109-T113 PolarHBondContact O-N 3.26Å; V109-T113 PolarHBondContact O-OG1 2.81Å; E110-T113 PolarHBondContact O-N 3.13Å; T113-W116 PolarHBondContact O-N 3.28Å; T113-N117 WeakPolarHBondContact O-CB 3.48Å; T113-N117 PolarHBondContact O-N 2.86Å; T113-L329 HydrophobicContact CG2-CD1 3.77Å |
| 114 | A | 93.5 | Very high | 91.4 | Very high | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -60.5 | -45.6 | 174 | 0 | 0 | 0 | 0 | 0 | 111.9 | E110 T111 N117 L118 L329 Y453 P454 | E110-A114 WeakPolarHBondContact O-CB 3.35Å; E110-A114 PolarHBondContact O-N 3.13Å; T111-A114 PolarHBondContact O-N 3.38Å; A114-N117 PolarHBondContact O-N 2.99Å; A114-L118 WeakPolarHBondContact O-CB 3.41Å; A114-L118 PolarHBondContact O-N 3.46Å; A114-L329 HydrophobicContact CB-CD2 3.77Å; A114-Y453 HydrophobicContact CB-CD1 4.35Å; A114-P454 HydrophobicContact CB-CG 4.27Å |
| 115 | H | 94.5 | Very high | 91.7 | Very high | 59 Ų | 59 | 32.8 Ų | 32.8 | 27% | 0.273 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -64 | -40.5 | 177.2 | -70 | 143.2 | 0 | 0 | 0 | 112.9 | T111 L112 L118 Y119 | T111-H115 WeakPolarHBondContact CG2-CE1 3.39Å; T111-H115 PolarHBondContact O-N 3.39Å; T111-H115 PolarHBondContact O-ND1 3.43Å; L112-H115 PolarHBondContact O-N 3.41Å; H115-L118 WeakPolarHBondContact O-CB 3.4Å; H115-L118 PolarHBondContact O-N 2.62Å; H115-Y119 HydrophobicContact CB-CE2 4.12Å; H115-Y119 WeakPolarHBondContact O-CD2 3.41Å; H115-Y119 PolarHBondContact O-N 3.37Å |
| 116 | W | 95.2 | Very high | 92 | Very high | 61 Ų | 61 | 32 Ų | 32 | 23% | 0.231 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -68.7 | -41.1 | 176.6 | -83.1 | 114.4 | 0 | 0 | 0 | 112.5 | L77 L112 T113 L118 Y119 I120 V172 V173 | L77-W116 HydrophobicContact CD1-CB 4.41Å; L112-W116 VanDerWaalsContact O-CD1 3.27Å; L112-W116 PolarHBondContact O-N 3.2Å; T113-W116 PolarHBondContact O-N 3.28Å; W116-L118 VanDerWaalsContact C-N 3.28Å; W116-L118 PolarHBondContact O-N 3.1Å; W116-Y119 HydrophobicContact CD2-CD2 4.39Å; W116-Y119 HydrophobicContact CE3-CD2 4.01Å; W116-Y119 HydrophobicContact CZ3-CD2 4.14Å; W116-Y119 PolarHBondContact O-N 3.48Å; W116-I120 VanDerWaalsContact O-CB 3.24Å; W116-I120 WeakPolarHBondContact O-CB 3.2Å; W116-I120 WeakPolarHBondContact O-CD1 3.24Å; W116-I120 WeakPolarHBondContact O-CG1 3.2Å; W116-I120 PolarHBondContact O-N 3.07Å; W116-V172 HydrophobicContact CB-CG1 4.1Å; W116-V172 HydrophobicContact CD2-CB 4.28Å; W116-V172 HydrophobicContact CD2-CG1 3.46Å; W116-V172 VanDerWaalsContact CD2-CG1 3.46Å; W116-V172 HydrophobicContact CE3-CG1 3.76Å; W116-V172 HydrophobicContact CG-CG1 3.61Å; W116-V172 HydrophobicContact CZ3-CG1 4.49Å; W116-V173 HydrophobicContact CH2-CB 4.09Å; W116-V173 HydrophobicContact CH2-CG2 3.31Å; W116-V173 HydrophobicContact CZ2-CG2 3.98Å; W116-V173 HydrophobicContact CZ3-CB 4.34Å; W116-V173 HydrophobicContact CZ3-CG2 4.03Å |
| 117 | N | 93.6 | Very high | 92.2 | Very high | 11 Ų | 11 | 32.6 Ų | 32.6 | 6% | 0.059 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -56.9 | -45.5 | 170.6 | -85.8 | -24 | 0 | 0 | 0 | 111.1 | T74 L77 T113 A114 I120 S121 | T74-N117 PolarHBondContact OG1-ND2 3.45Å; L77-N117 VanDerWaalsContact CD1-OD1 3.26Å; L77-N117 WeakPolarHBondContact CD1-OD1 3.47Å; T113-N117 WeakPolarHBondContact O-CB 3.48Å; T113-N117 PolarHBondContact O-N 2.86Å; A114-N117 PolarHBondContact O-N 2.99Å; N117-I120 PolarHBondContact O-N 3.13Å; N117-S121 VanDerWaalsContact O-CB 3.28Å; N117-S121 WeakPolarHBondContact O-CB 3.14Å; N117-S121 PolarHBondContact O-N 3.18Å; N117-S121 PolarHBondContact O-OG 2.97Å |
| 118 | L | 93.3 | Very high | 92.2 | Very high | 11 Ų | 11 | 29.6 Ų | 29.6 | 6% | 0.058 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -55.9 | -55.2 | 174.4 | 176.5 | 63.9 | 0 | 0 | 0 | 111.5 | A114 H115 W116 I120 S121 L122 N450 | A114-L118 WeakPolarHBondContact O-CB 3.41Å; A114-L118 PolarHBondContact O-N 3.46Å; H115-L118 WeakPolarHBondContact O-CB 3.4Å; H115-L118 PolarHBondContact O-N 2.62Å; W116-L118 VanDerWaalsContact C-N 3.28Å; W116-L118 PolarHBondContact O-N 3.1Å; L118-I120 PolarHBondContact O-N 3.49Å; L118-S121 PolarHBondContact O-N 3.49Å; L118-L122 HydrophobicContact CD1-CD1 3.69Å; L118-L122 HydrophobicContact CD1-CD2 4.3Å; L118-L122 HydrophobicContact CD1-CG 3.75Å; L118-L122 HydrophobicContact CG-CD1 3.79Å; L118-L122 HydrophobicContact CG-CG 4.2Å; L118-L122 VanDerWaalsContact O-CB 3.26Å; L118-L122 WeakPolarHBondContact O-CB 3.35Å; L118-L122 WeakPolarHBondContact O-CG 3.5Å; L118-L122 PolarHBondContact O-N 3.29Å; L118-N450 HydrophobicContact CB-CB 3.68Å; L118-N450 HydrophobicContact CD1-CB 4.09Å; L118-N450 HydrophobicContact CG-CB 4.35Å |
| 119 | Y | 94.6 | Very high | 92 | Very high | 117 Ų | 117 | 27.7 Ų | 27.7 | 46% | 0.459 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -62 | -43.3 | -177.1 | -61.4 | -35.3 | 0 | 0 | 0 | 112.3 | H115 W116 G123 L176 | H115-Y119 HydrophobicContact CB-CE2 4.12Å; H115-Y119 WeakPolarHBondContact O-CD2 3.41Å; H115-Y119 PolarHBondContact O-N 3.37Å; W116-Y119 HydrophobicContact CD2-CD2 4.39Å; W116-Y119 HydrophobicContact CE3-CD2 4.01Å; W116-Y119 HydrophobicContact CZ3-CD2 4.14Å; W116-Y119 PolarHBondContact O-N 3.48Å; Y119-G123 PolarHBondContact O-N 3.49Å; Y119-L176 VanDerWaalsContact O-CD1 3.26Å; Y119-L176 WeakPolarHBondContact O-CD1 3.22Å |
| 120 | I | 93.9 | Very high | 91.7 | Very high | 1 Ų | 1 | 31.7 Ų | 31.7 | 1% | 0.005 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62.9 | -46.5 | 178.6 | -71.5 | 168.7 | 0 | 0 | 0 | 110.2 | L77 W116 N117 L118 G123 G124 F175 R179 | L77-I120 HydrophobicContact CD1-CD1 3.94Å; L77-I120 HydrophobicContact CD2-CD1 4.23Å; W116-I120 VanDerWaalsContact O-CB 3.24Å; W116-I120 WeakPolarHBondContact O-CB 3.2Å; W116-I120 WeakPolarHBondContact O-CD1 3.24Å; W116-I120 WeakPolarHBondContact O-CG1 3.2Å; W116-I120 PolarHBondContact O-N 3.07Å; N117-I120 PolarHBondContact O-N 3.13Å; L118-I120 PolarHBondContact O-N 3.49Å; I120-G123 PolarHBondContact O-N 3.42Å; I120-G124 PolarHBondContact O-N 2.91Å; I120-F175 HydrophobicContact CD1-CB 3.64Å; I120-F175 HydrophobicContact CD1-CG 4.37Å; I120-F175 HydrophobicContact CG1-CB 4.09Å; I120-R179 HydrophobicContact CG2-CB 4.49Å; I120-R179 HydrophobicContact CG2-CG 3.45Å; I120-R179 VanDerWaalsContact CG2-CG 3.45Å; I120-R179 WeakPolarHBondContact O-CG 3.38Å |
| 121 | S | 91.3 | Very high | 91.5 | Very high | 1 Ų | 1 | 32.9 Ų | 32.9 | 1% | 0.007 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -70.7 | -41.3 | 178.7 | -77.3 | 0 | 0 | 0 | 0 | 112.8 | N117 L118 G123 G124 F125 R179 E325 S446 | N117-S121 VanDerWaalsContact O-CB 3.28Å; N117-S121 WeakPolarHBondContact O-CB 3.14Å; N117-S121 PolarHBondContact O-N 3.18Å; N117-S121 PolarHBondContact O-OG 2.97Å; L118-S121 PolarHBondContact O-N 3.49Å; S121-G123 VanDerWaalsContact C-N 3.3Å; S121-G123 PolarHBondContact O-N 3.05Å; S121-G124 PolarHBondContact O-N 3.24Å; S121-F125 WeakPolarHBondContact O-CB 3.4Å; S121-F125 WeakPolarHBondContact O-CD2 3.38Å; S121-F125 WeakPolarHBondContact O-CG 3.41Å; S121-F125 PolarHBondContact O-N 2.99Å; S121-R179 PolarHBondContact OG-NH2 3.06Å; S121-E325 WeakPolarHBondContact CB-OE1 3.28Å; S121-E325 PolarHBondContact OG-OE1 2.62Å; S121-S446 VanDerWaalsContact CB-OG 3.24Å; S121-S446 WeakPolarHBondContact CB-OG 3.35Å |
| 122 | L | 91.3 | Very high | 91.1 | Very high | 49 Ų | 49 | 31.6 Ų | 31.6 | 26% | 0.257 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -58.3 | -42.6 | 173 | -75.8 | 179.2 | 0 | 0 | 0 | 111.3 | L118 S126 L443 | L118-L122 HydrophobicContact CD1-CD1 3.69Å; L118-L122 HydrophobicContact CD1-CD2 4.3Å; L118-L122 HydrophobicContact CD1-CG 3.75Å; L118-L122 HydrophobicContact CG-CD1 3.79Å; L118-L122 HydrophobicContact CG-CG 4.2Å; L118-L122 VanDerWaalsContact O-CB 3.26Å; L118-L122 WeakPolarHBondContact O-CB 3.35Å; L118-L122 WeakPolarHBondContact O-CG 3.5Å; L118-L122 PolarHBondContact O-N 3.29Å; L122-S126 WeakPolarHBondContact O-CB 3.5Å; L122-S126 PolarHBondContact O-N 3.17Å; L122-S126 PolarHBondContact O-OG 3.35Å; L122-L443 HydrophobicContact CD2-CD1 3.5Å; L122-L443 HydrophobicContact CD2-CG 4.31Å |
| 123 | G | 90.1 | Very high | 90.4 | Very high | 9 Ų | 9 | 30.3 Ų | 30.3 | 9% | 0.093 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -57.3 | -53.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y119 I120 S121 S126 V127 L180 | Y119-G123 PolarHBondContact O-N 3.49Å; I120-G123 PolarHBondContact O-N 3.42Å; S121-G123 VanDerWaalsContact C-N 3.3Å; S121-G123 PolarHBondContact O-N 3.05Å; G123-S126 PolarHBondContact O-OG 3.31Å; G123-V127 WeakPolarHBondContact O-CG2 3.39Å; G123-L180 WeakPolarHBondContact O-CD2 3.41Å |
| 124 | G | 90.3 | Very high | 89.8 | Confident | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -65.5 | -49.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | I120 S121 G128 | I120-G124 PolarHBondContact O-N 2.91Å; S121-G124 PolarHBondContact O-N 3.24Å; G124-G128 PolarHBondContact O-N 3.03Å |
| 125 | F | 89.8 | Confident | 89.3 | Confident | 26 Ų | 26 | 31.4 Ų | 31.4 | 11% | 0.114 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -73.2 | -31.5 | -174 | -61.9 | -36.1 | 0 | 0 | 0 | 113.6 | S121 G128 L129 F442 L443 | S121-F125 WeakPolarHBondContact O-CB 3.4Å; S121-F125 WeakPolarHBondContact O-CD2 3.38Å; S121-F125 WeakPolarHBondContact O-CG 3.41Å; S121-F125 PolarHBondContact O-N 2.99Å; F125-G128 PolarHBondContact O-N 3.24Å; F125-L129 VanDerWaalsContact O-CB 3.28Å; F125-L129 WeakPolarHBondContact O-CB 3.29Å; F125-L129 PolarHBondContact O-N 3.08Å; F125-F442 HydrophobicContact CD1-CB 4.26Å; F125-F442 HydrophobicContact CD2-CB 4.13Å; F125-F442 HydrophobicContact CE1-CB 4.36Å; F125-F442 HydrophobicContact CE1-CD2 4.21Å; F125-F442 HydrophobicContact CE2-CB 4.23Å; F125-F442 HydrophobicContact CG-CB 4.15Å; F125-F442 HydrophobicContact CZ-CB 4.35Å; F125-L443 HydrophobicContact CB-CB 4.41Å; F125-L443 HydrophobicContact CB-CD1 4.07Å |
| 126 | S | 90.5 | Very high | 88.6 | Confident | 52 Ų | 52 | 29.9 Ų | 29.9 | 36% | 0.364 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -65.5 | -43.2 | 175.8 | 59.9 | 0 | 0 | 0 | 0 | 111.7 | L122 G123 | L122-S126 WeakPolarHBondContact O-CB 3.5Å; L122-S126 PolarHBondContact O-N 3.17Å; L122-S126 PolarHBondContact O-OG 3.35Å; G123-S126 PolarHBondContact O-OG 3.31Å |
| 127 | V | 91.5 | Very high | 87.7 | Confident | 31 Ų | 31 | 27.6 Ų | 27.6 | 19% | 0.188 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -66.8 | -46.8 | 173.8 | 179.6 | 0 | 0 | 0 | 0 | 110.2 | G123 L129 V130 I131 L180 L184 | G123-V127 WeakPolarHBondContact O-CG2 3.39Å; V127-L129 VanDerWaalsContact C-N 3.29Å; V127-L129 PolarHBondContact O-N 3.48Å; V127-V130 PolarHBondContact O-N 3.08Å; V127-V130 VanDerWaalsContact O-N 3.11Å; V127-I131 HydrophobicContact CG1-CG1 3.96Å; V127-I131 WeakPolarHBondContact O-CG1 3.32Å; V127-I131 PolarHBondContact O-N 3.38Å; V127-L180 HydrophobicContact CG2-CD2 3.6Å; V127-L184 HydrophobicContact CG1-CB 4.37Å; V127-L184 HydrophobicContact CG1-CD2 3.58Å; V127-L184 HydrophobicContact CG1-CG 3.8Å |
| 128 | G | 87.1 | Confident | 87.1 | Confident | 3 Ų | 3 | 29.5 Ų | 29.5 | 3% | 0.031 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -58.5 | -36.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | G124 F125 V130 I131 V132 | G124-G128 PolarHBondContact O-N 3.03Å; F125-G128 PolarHBondContact O-N 3.24Å; G128-V130 PolarHBondContact O-N 2.86Å; G128-I131 PolarHBondContact O-N 2.94Å; G128-V132 VanDerWaalsContact O-CB 3.24Å; G128-V132 WeakPolarHBondContact O-CB 3.29Å; G128-V132 WeakPolarHBondContact O-CG2 3.39Å; G128-V132 PolarHBondContact O-N 3.12Å |
| 129 | L | 85.9 | Confident | 86.6 | Confident | 49 Ų | 49 | 29.1 Ų | 29.1 | 26% | 0.257 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -57.7 | -33.4 | 177.3 | -179.8 | 64.3 | 0 | 0 | 0 | 112.4 | F125 V127 P133 L440 L443 | F125-L129 VanDerWaalsContact O-CB 3.28Å; F125-L129 WeakPolarHBondContact O-CB 3.29Å; F125-L129 PolarHBondContact O-N 3.08Å; V127-L129 VanDerWaalsContact C-N 3.29Å; V127-L129 PolarHBondContact O-N 3.48Å; L129-P133 WeakPolarHBondContact O-CD 3.4Å; L129-P133 WeakPolarHBondContact O-CG 3.26Å; L129-L440 HydrophobicContact CD1-CB 4.14Å; L129-L440 HydrophobicContact CD2-CD1 4.2Å; L129-L443 HydrophobicContact CD2-CD2 4.04Å |
| 130 | V | 86.3 | Confident | 85.8 | Confident | 84 Ų | 84 | 26.5 Ų | 26.5 | 51% | 0.509 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -85.8 | -44.6 | 176.7 | -177.7 | 0 | 0 | 0 | 0 | 110.7 | V127 G128 L134 | V127-V130 PolarHBondContact O-N 3.08Å; V127-V130 VanDerWaalsContact O-N 3.11Å; G128-V130 PolarHBondContact O-N 2.86Å; V130-L134 HydrophobicContact CG1-CD1 4.23Å; V130-L134 WeakPolarHBondContact O-CD1 3.48Å; V130-L134 VanDerWaalsContact O-CG 3.25Å; V130-L134 WeakPolarHBondContact O-CG 3.49Å |
| 131 | I | 87.8 | Confident | 85 | Confident | 35 Ų | 35 | 29 Ų | 29 | 18% | 0.179 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -76.3 | -40.6 | -171.4 | -64.8 | -62.3 | 0 | 0 | 0 | 113 | V127 G128 L134 L135 L184 | V127-I131 HydrophobicContact CG1-CG1 3.96Å; V127-I131 WeakPolarHBondContact O-CG1 3.32Å; V127-I131 PolarHBondContact O-N 3.38Å; G128-I131 PolarHBondContact O-N 2.94Å; I131-L134 WeakPolarHBondContact O-CB 3.39Å; I131-L134 PolarHBondContact O-N 3.4Å; I131-L135 HydrophobicContact CG2-CD1 3.59Å; I131-L135 HydrophobicContact CG2-CG 3.87Å; I131-L135 WeakPolarHBondContact O-CG 3.41Å; I131-L135 PolarHBondContact O-N 3.32Å; I131-L184 WeakPolarHBondContact CG2-O 3.23Å |
| 132 | V | 84.8 | Confident | 84.4 | Confident | 9 Ų | 9 | 29.9 Ų | 29.9 | 6% | 0.055 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -61.8 | -47.1 | -174.7 | 173.5 | 0 | 0 | 0 | 0 | 112.3 | G128 L134 L135 G136 G186 N189 A190 | G128-V132 VanDerWaalsContact O-CB 3.24Å; G128-V132 WeakPolarHBondContact O-CB 3.29Å; G128-V132 WeakPolarHBondContact O-CG2 3.39Å; G128-V132 PolarHBondContact O-N 3.12Å; V132-L134 VanDerWaalsContact C-N 3.29Å; V132-L134 PolarHBondContact O-N 2.97Å; V132-L135 PolarHBondContact O-N 2.81Å; V132-G136 PolarHBondContact O-N 2.89Å; V132-G186 WeakPolarHBondContact CG2-O 3.47Å; V132-N189 HydrophobicContact CG1-CB 4.31Å; V132-N189 HydrophobicContact CG2-CB 4.08Å; V132-A190 HydrophobicContact CG2-CB 4.43Å |
| 133 | P | 79.3 | Confident | 84 | Confident | 28 Ų | 28 | 27.5 Ų | 27.5 | 18% | 0.182 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -61.9 | -37 | 175 | -24.9 | 36.3 | 0 | 0 | 0 | 113 | L129 G136 S137 | L129-P133 WeakPolarHBondContact O-CD 3.4Å; L129-P133 WeakPolarHBondContact O-CG 3.26Å; P133-G136 PolarHBondContact O-N 3.43Å; P133-S137 PolarHBondContact O-N 2.81Å; P133-S137 PolarHBondContact O-OG 3.33Å |
| 134 | L | 82.3 | Confident | 83.7 | Confident | 17 Ų | 17 | 27.8 Ų | 27.8 | 9% | 0.089 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -64.8 | -49.6 | 177.1 | -65.5 | 176.7 | 0 | 0 | 0 | 110.8 | V130 I131 V132 G136 S137 W138 L273 L274 | V130-L134 HydrophobicContact CG1-CD1 4.23Å; V130-L134 WeakPolarHBondContact O-CD1 3.48Å; V130-L134 VanDerWaalsContact O-CG 3.25Å; V130-L134 WeakPolarHBondContact O-CG 3.49Å; I131-L134 WeakPolarHBondContact O-CB 3.39Å; I131-L134 PolarHBondContact O-N 3.4Å; V132-L134 VanDerWaalsContact C-N 3.29Å; V132-L134 PolarHBondContact O-N 2.97Å; L134-G136 VanDerWaalsContact C-N 3.31Å; L134-G136 PolarHBondContact O-N 3.11Å; L134-S137 PolarHBondContact O-N 3.2Å; L134-S137 PolarHBondContact O-OG 3.09Å; L134-W138 VanDerWaalsContact O-CB 3.23Å; L134-W138 WeakPolarHBondContact O-CB 3.44Å; L134-W138 PolarHBondContact O-N 3.11Å; L134-L273 HydrophobicContact CB-CD2 4.05Å; L134-L273 HydrophobicContact CD1-CD2 4.2Å; L134-L274 HydrophobicContact CD1-CD2 3.85Å; L134-L274 HydrophobicContact CD2-CD2 3.79Å; L134-L274 HydrophobicContact CG-CD2 4.47Å |
| 135 | L | 82.7 | Confident | 83.7 | Confident | 6 Ų | 6 | 30.9 Ų | 30.9 | 3% | 0.031 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -60.9 | -39.4 | 175.2 | -70.9 | 178.9 | 0 | 0 | 0 | 112 | I131 V132 W138 S139 V147 L150 S185 A190 | I131-L135 HydrophobicContact CG2-CD1 3.59Å; I131-L135 HydrophobicContact CG2-CG 3.87Å; I131-L135 WeakPolarHBondContact O-CG 3.41Å; I131-L135 PolarHBondContact O-N 3.32Å; V132-L135 PolarHBondContact O-N 2.81Å; L135-W138 HydrophobicContact CD2-CE3 4.12Å; L135-W138 HydrophobicContact CD2-CZ3 4.46Å; L135-W138 PolarHBondContact O-N 3.33Å; L135-S139 VanDerWaalsContact O-CB 3.31Å; L135-S139 WeakPolarHBondContact O-CB 3.47Å; L135-S139 PolarHBondContact O-N 2.86Å; L135-V147 HydrophobicContact CB-CG1 4.32Å; L135-L150 HydrophobicContact CD1-CD2 4.39Å; L135-L150 HydrophobicContact CD2-CD2 4Å; L135-S185 VanDerWaalsContact CD1-O 3.31Å; L135-S185 WeakPolarHBondContact CD1-O 3.34Å; L135-A190 HydrophobicContact CD1-CB 4.31Å |
| 136 | G | 78.6 | Confident | 83.6 | Confident | 28 Ų | 28 | 32.6 Ų | 32.6 | 29% | 0.289 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -58.4 | -54.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | V132 P133 L134 W138 S139 D140 | V132-G136 PolarHBondContact O-N 2.89Å; P133-G136 PolarHBondContact O-N 3.43Å; L134-G136 VanDerWaalsContact C-N 3.31Å; L134-G136 PolarHBondContact O-N 3.11Å; G136-W138 VanDerWaalsContact C-N 3.28Å; G136-W138 PolarHBondContact O-N 3.35Å; G136-S139 PolarHBondContact O-N 2.85Å; G136-S139 PolarHBondContact O-OG 3.43Å; G136-D140 PolarHBondContact O-N 3.01Å |
| 137 | S | 76.7 | Confident | 83.4 | Confident | 13 Ų | 13 | 30.3 Ų | 30.3 | 9% | 0.091 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63.1 | -34.2 | 178.8 | 69.2 | 0 | 0 | 0 | 0 | 113.7 | P133 L134 H278 | P133-S137 PolarHBondContact O-N 2.81Å; P133-S137 PolarHBondContact O-OG 3.33Å; L134-S137 PolarHBondContact O-N 3.2Å; L134-S137 PolarHBondContact O-OG 3.09Å; S137-H278 VanDerWaalsContact CB-CE1 3.45Å; S137-H278 WeakPolarHBondContact CB-CE1 3.44Å; S137-H278 WeakPolarHBondContact CB-ND1 3.43Å |
| 138 | W | 80.6 | Confident | 83.4 | Confident | 51 Ų | 51 | 28.9 Ų | 28.9 | 19% | 0.193 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -72 | -36.4 | 177.5 | 179.2 | 66.9 | 0 | 0 | 0 | 111.5 | L134 L135 G136 D140 V141 A142 T146 V147 L273 | L134-W138 VanDerWaalsContact O-CB 3.23Å; L134-W138 WeakPolarHBondContact O-CB 3.44Å; L134-W138 PolarHBondContact O-N 3.11Å; L135-W138 HydrophobicContact CD2-CE3 4.12Å; L135-W138 HydrophobicContact CD2-CZ3 4.46Å; L135-W138 PolarHBondContact O-N 3.33Å; G136-W138 VanDerWaalsContact C-N 3.28Å; G136-W138 PolarHBondContact O-N 3.35Å; W138-D140 PolarHBondContact O-N 3.04Å; W138-V141 PolarHBondContact O-N 3.36Å; W138-A142 HydrophobicContact CD2-CB 3.76Å; W138-A142 HydrophobicContact CE3-CB 4.45Å; W138-A142 HydrophobicContact CG-CB 4.11Å; W138-A142 HydrophobicContact CH2-CB 4.27Å; W138-A142 HydrophobicContact CZ2-CB 3.52Å; W138-A142 VanDerWaalsContact NE1-CB 3.27Å; W138-A142 WeakPolarHBondContact O-CB 3.39Å; W138-A142 PolarHBondContact O-N 3.02Å; W138-T146 HydrophobicContact CH2-CG2 3.57Å; W138-T146 HydrophobicContact CZ3-CG2 3.85Å; W138-V147 HydrophobicContact CE3-CG2 3.62Å; W138-V147 HydrophobicContact CZ3-CG2 3.7Å; W138-L273 HydrophobicContact CD2-CD1 4.47Å; W138-L273 HydrophobicContact CG-CB 4.49Å; W138-L273 HydrophobicContact CG-CG 4.45Å |
| 139 | S | 83.8 | Confident | 83.8 | Confident | 3 Ų | 3 | 30.6 Ų | 30.6 | 2% | 0.021 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62.8 | -25.9 | 178.5 | 75.4 | 0 | 0 | 0 | 0 | 113.7 | L135 G136 V141 G143 R144 V147 | L135-S139 VanDerWaalsContact O-CB 3.31Å; L135-S139 WeakPolarHBondContact O-CB 3.47Å; L135-S139 PolarHBondContact O-N 2.86Å; G136-S139 PolarHBondContact O-N 2.85Å; G136-S139 PolarHBondContact O-OG 3.43Å; S139-V141 PolarHBondContact O-N 3.09Å; S139-G143 CarbonylContact O-C 3.58Å; S139-G143 PolarHBondContact O-N 2.73Å; S139-R144 PolarHBondContact OG-NH1 3Å; S139-V147 VanDerWaalsContact CB-CG2 3.5Å |
| 140 | D | 77.3 | Confident | 84.2 | Confident | 62 Ų | 62 | 31.6 Ų | 31.6 | 33% | 0.332 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -68.5 | -14.4 | 175.5 | -66.1 | -30.2 | 0 | 0 | 0 | 113.1 | G136 W138 R144 V265 H278 | G136-D140 PolarHBondContact O-N 3.01Å; W138-D140 PolarHBondContact O-N 3.04Å; D140-R144 IonicContact OD1-CZ 3.66Å; D140-R144 IonicContact OD1-NH1 3.77Å; D140-R144 PolarHBondContact OD1-NH1 3.49Å; D140-R144 IonicContact OD1-NH2 2.62Å; D140-R144 PolarHBondContact OD1-NH2 3.49Å; D140-V265 WeakPolarHBondContact O-CG1 3.32Å; D140-H278 IonicContact OD2-CE1 3.49Å; D140-H278 PolarHBondContact OD2-CE1 2.89Å; D140-H278 IonicContact OD2-NE2 3.01Å |
| 141 | V | 78.1 | Confident | 84.6 | Confident | 54 Ų | 54 | 27.6 Ų | 27.6 | 33% | 0.327 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -126.9 | -38.4 | -171.8 | -168.9 | 0 | 0 | 0 | 0 | 112 | W138 S139 P267 D268 A271 | W138-V141 PolarHBondContact O-N 3.36Å; S139-V141 PolarHBondContact O-N 3.09Å; V141-P267 WeakPolarHBondContact O-CA 3.44Å; V141-D268 HydrophobicContact CG1-CB 3.7Å; V141-D268 PolarHBondContact O-N 3.35Å; V141-A271 HydrophobicContact CB-CB 4.03Å; V141-A271 HydrophobicContact CG1-CB 3.63Å |
| 142 | A | 78.3 | Confident | 85 | Confident | 18 Ų | 18 | 25.9 Ų | 25.9 | 15% | 0.149 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -91.1 | -9.9 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | W138 A271 | W138-A142 HydrophobicContact CD2-CB 3.76Å; W138-A142 HydrophobicContact CE3-CB 4.45Å; W138-A142 HydrophobicContact CG-CB 4.11Å; W138-A142 HydrophobicContact CH2-CB 4.27Å; W138-A142 HydrophobicContact CZ2-CB 3.52Å; W138-A142 VanDerWaalsContact NE1-CB 3.27Å; W138-A142 WeakPolarHBondContact O-CB 3.39Å; W138-A142 PolarHBondContact O-N 3.02Å; A142-A271 HydrophobicContact CB-CB 4.14Å |
| 143 | G | 82.6 | Confident | 85.6 | Confident | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 17% | 0.168 | C | C | . | . | trans | 109.8 | 146.8 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | S139 E263 | S139-G143 CarbonylContact O-C 3.58Å; S139-G143 PolarHBondContact O-N 2.73Å; G143-E263 WeakPolarHBondContact CA-OE1 3.48Å; G143-E263 VanDerWaalsContact CA-OE2 3.32Å; G143-E263 WeakPolarHBondContact CA-OE2 3.46Å | ||
| 144 | R | 84.6 | Confident | 86.4 | Confident | 15 Ų | 15 | 30.1 Ų | 30.1 | 6% | 0.057 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -77.1 | -30.7 | -178.7 | -62.6 | -60.1 | -169.4 | -163.9 | -9.8 | 112.4 | S139 D140 T146 V147 L148 Y198 D201 E263 S264 V265 | S139-R144 PolarHBondContact OG-NH1 3Å; D140-R144 IonicContact OD1-CZ 3.66Å; D140-R144 IonicContact OD1-NH1 3.77Å; D140-R144 PolarHBondContact OD1-NH1 3.49Å; D140-R144 IonicContact OD1-NH2 2.62Å; D140-R144 PolarHBondContact OD1-NH2 3.49Å; R144-T146 VanDerWaalsContact C-N 3.35Å; R144-T146 PolarHBondContact O-N 2.85Å; R144-V147 PolarHBondContact O-N 3.42Å; R144-L148 PolarHBondContact O-N 3.38Å; R144-Y198 HydrophobicContact CB-CD2 3.96Å; R144-Y198 HydrophobicContact CG-CD2 4.29Å; R144-D201 IonicContact CZ-OD2 3.16Å; R144-D201 IonicContact NE-OD2 3.13Å; R144-D201 PolarHBondContact NE-OD2 2.95Å; R144-D201 IonicContact NH2-OD1 3.95Å; R144-D201 IonicContact NH2-OD2 3.66Å; R144-E263 PolarHBondContact N-OE1 3.16Å; R144-E263 PolarHBondContact N-OE2 3.15Å; R144-S264 WeakPolarHBondContact CG-OG 3.38Å; R144-V265 HydrophobicContact CG-CG2 4.12Å |
| 145 | R | 89.6 | Confident | 87.1 | Confident | 64 Ų | 64 | 29.4 Ų | 29.4 | 24% | 0.242 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -61.5 | -42.8 | -173.7 | 175.5 | 174.3 | 159.3 | 172.6 | -10.6 | 112 | V147 L148 I149 Y258 E263 | R145-V147 VanDerWaalsContact C-N 3.29Å; R145-V147 PolarHBondContact O-N 3.28Å; R145-L148 PolarHBondContact O-N 2.86Å; R145-L148 VanDerWaalsContact O-N 3.13Å; R145-I149 HydrophobicContact CG-CD1 3.7Å; R145-I149 HydrophobicContact CG-CG1 4.46Å; R145-I149 WeakPolarHBondContact O-CG1 3.44Å; R145-I149 PolarHBondContact O-N 2.91Å; R145-I149 VanDerWaalsContact O-N 3.13Å; R145-Y258 PolarHBondContact NH1-O 2.94Å; R145-Y258 VanDerWaalsContact NH1-O 3.07Å; R145-Y258 PolarHBondContact NH2-O 3.03Å; R145-E263 WeakPolarHBondContact CB-OE2 3.26Å; R145-E263 PolarHBondContact N-OE2 2.75Å |
| 146 | T | 87.3 | Confident | 87.8 | Confident | 63 Ų | 63 | 29.3 Ų | 29.3 | 39% | 0.387 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -64.2 | -36.5 | -178.3 | -50.2 | 0 | 0 | 0 | 0 | 112.2 | W138 R144 L148 I149 L150 | W138-T146 HydrophobicContact CH2-CG2 3.57Å; W138-T146 HydrophobicContact CZ3-CG2 3.85Å; R144-T146 VanDerWaalsContact C-N 3.35Å; R144-T146 PolarHBondContact O-N 2.85Å; T146-L148 VanDerWaalsContact C-N 3.27Å; T146-L148 PolarHBondContact O-N 3.47Å; T146-I149 PolarHBondContact O-N 2.85Å; T146-L150 WeakPolarHBondContact O-CB 3.5Å; T146-L150 PolarHBondContact O-N 3.46Å |
| 147 | V | 87.2 | Confident | 88.7 | Confident | 4 Ų | 4 | 31.1 Ų | 31.1 | 2% | 0.024 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -75.5 | -14.7 | 178.4 | 177 | 0 | 0 | 0 | 0 | 112.9 | L135 W138 S139 R144 R145 P151 | L135-V147 HydrophobicContact CB-CG1 4.32Å; W138-V147 HydrophobicContact CE3-CG2 3.62Å; W138-V147 HydrophobicContact CZ3-CG2 3.7Å; S139-V147 VanDerWaalsContact CB-CG2 3.5Å; R144-V147 PolarHBondContact O-N 3.42Å; R145-V147 VanDerWaalsContact C-N 3.29Å; R145-V147 PolarHBondContact O-N 3.28Å; V147-P151 WeakPolarHBondContact O-CD 3.46Å; V147-P151 WeakPolarHBondContact O-CG 3.41Å |
| 148 | L | 91.3 | Very high | 89.7 | Confident | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -85.9 | -31.8 | 168.6 | -66.2 | 174.9 | 0 | 0 | 0 | 112.7 | V55 R144 R145 T146 N152 V191 A257 I261 | V55-L148 HydrophobicContact CG1-CD1 3.9Å; R144-L148 PolarHBondContact O-N 3.38Å; R145-L148 PolarHBondContact O-N 2.86Å; R145-L148 VanDerWaalsContact O-N 3.13Å; T146-L148 VanDerWaalsContact C-N 3.27Å; T146-L148 PolarHBondContact O-N 3.47Å; L148-N152 PolarHBondContact O-ND2 3.4Å; L148-V191 HydrophobicContact CD2-CG1 4.48Å; L148-A257 HydrophobicContact CB-CB 4.31Å; L148-I261 HydrophobicContact CD1-CD1 3.57Å; L148-I261 HydrophobicContact CD1-CG2 4.35Å |
| 149 | I | 94.6 | Very high | 90.5 | Very high | 40 Ų | 40 | 28.2 Ų | 28.2 | 21% | 0.205 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -80.3 | -47.7 | -178.3 | -64.4 | 166.7 | 0 | 0 | 0 | 111.3 | R145 T146 N152 F153 A254 A257 Y258 | R145-I149 HydrophobicContact CG-CD1 3.7Å; R145-I149 HydrophobicContact CG-CG1 4.46Å; R145-I149 WeakPolarHBondContact O-CG1 3.44Å; R145-I149 PolarHBondContact O-N 2.91Å; R145-I149 VanDerWaalsContact O-N 3.13Å; T146-I149 PolarHBondContact O-N 2.85Å; I149-N152 PolarHBondContact O-N 3.27Å; I149-F153 PolarHBondContact O-N 3.34Å; I149-A254 HydrophobicContact CG2-CB 4.32Å; I149-A257 HydrophobicContact CG1-CB 3.68Å; I149-Y258 HydrophobicContact CD1-CD2 4.18Å |
| 150 | L | 94.9 | Very high | 91.2 | Very high | 69 Ų | 69 | 31 Ų | 31 | 36% | 0.361 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -56.8 | -47.5 | -172.1 | 179.9 | 66.8 | 0 | 0 | 0 | 113.4 | L135 T146 N152 F153 G154 | L135-L150 HydrophobicContact CD1-CD2 4.39Å; L135-L150 HydrophobicContact CD2-CD2 4Å; T146-L150 WeakPolarHBondContact O-CB 3.5Å; T146-L150 PolarHBondContact O-N 3.46Å; L150-N152 PolarHBondContact O-N 2.86Å; L150-F153 WeakPolarHBondContact O-CB 3.4Å; L150-F153 PolarHBondContact O-N 2.81Å; L150-G154 PolarHBondContact O-N 3.32Å; L150-G154 VanDerWaalsContact O-N 3.1Å |
| 151 | P | 95.1 | Very high | 92.2 | Very high | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -71.3 | -32.5 | -178.4 | -9.4 | 23.4 | 0 | 0 | 0 | 112.7 | V147 F153 G154 L155 S185 D187 A190 V191 | V147-P151 WeakPolarHBondContact O-CD 3.46Å; V147-P151 WeakPolarHBondContact O-CG 3.41Å; P151-F153 VanDerWaalsContact C-N 3.29Å; P151-F153 PolarHBondContact O-N 2.73Å; P151-G154 PolarHBondContact O-N 2.97Å; P151-L155 WeakPolarHBondContact O-CG 3.47Å; P151-L155 PolarHBondContact O-N 3.26Å; P151-S185 WeakPolarHBondContact CA-O 3.36Å; P151-S185 WeakPolarHBondContact CA-OG 3.11Å; P151-S185 WeakPolarHBondContact CB-O 3.48Å; P151-S185 VanDerWaalsContact CG-O 3.31Å; P151-S185 WeakPolarHBondContact CG-O 3.35Å; P151-D187 WeakPolarHBondContact CB-O 3.31Å; P151-A190 HydrophobicContact CB-CB 4.18Å; P151-A190 HydrophobicContact CG-CB 3.55Å; P151-V191 HydrophobicContact CB-CG2 3.71Å; P151-V191 HydrophobicContact CG-CG2 4.04Å |
| 152 | N | 96.6 | Very high | 93.1 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -62.9 | -37.5 | 172.9 | -84.1 | -67.2 | 0 | 0 | 0 | 111.9 | S62 L148 I149 L150 A156 S253 A254 | S62-N152 PolarHBondContact OG-ND2 3.48Å; S62-N152 PolarHBondContact OG-OD1 3.05Å; L148-N152 PolarHBondContact O-ND2 3.4Å; I149-N152 PolarHBondContact O-N 3.27Å; L150-N152 PolarHBondContact O-N 2.86Å; N152-A156 WeakPolarHBondContact O-CB 3.34Å; N152-A156 PolarHBondContact O-N 3.02Å; N152-S253 PolarHBondContact ND2-OG 2.62Å; N152-S253 WeakPolarHBondContact OD1-CB 3.47Å; N152-S253 PolarHBondContact OD1-OG 2.9Å; N152-A254 HydrophobicContact CB-CB 3.89Å |
| 153 | F | 96.3 | Very high | 94 | Very high | 123 Ų | 123 | 26.2 Ų | 26.2 | 54% | 0.539 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -66.6 | -39.6 | 173.4 | -171.3 | -97.3 | 0 | 0 | 0 | 112.2 | I149 L150 P151 A156 L157 | I149-F153 PolarHBondContact O-N 3.34Å; L150-F153 WeakPolarHBondContact O-CB 3.4Å; L150-F153 PolarHBondContact O-N 2.81Å; P151-F153 VanDerWaalsContact C-N 3.29Å; P151-F153 PolarHBondContact O-N 2.73Å; F153-A156 WeakPolarHBondContact O-CB 3.46Å; F153-A156 PolarHBondContact O-N 3.29Å; F153-L157 PolarHBondContact O-N 3.43Å |
| 154 | G | 96.5 | Very high | 94.7 | Very high | 3 Ų | 3 | 29.3 Ų | 29.3 | 3% | 0.031 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -68.8 | -35.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | L150 P151 L157 Q158 S185 | L150-G154 PolarHBondContact O-N 3.32Å; L150-G154 VanDerWaalsContact O-N 3.1Å; P151-G154 PolarHBondContact O-N 2.97Å; G154-L157 PolarHBondContact O-N 3.31Å; G154-Q158 WeakPolarHBondContact O-CB 3.23Å; G154-Q158 PolarHBondContact O-N 3.24Å; G154-S185 WeakPolarHBondContact CA-OG 3.48Å |
| 155 | L | 96.9 | Very high | 95.2 | Very high | 2 Ų | 2 | 28.7 Ų | 28.7 | 1% | 0.01 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -63.6 | -39.7 | 170.1 | -73.8 | 169.6 | 0 | 0 | 0 | 111.9 | P151 Q158 A159 S182 D187 N250 | P151-L155 WeakPolarHBondContact O-CG 3.47Å; P151-L155 PolarHBondContact O-N 3.26Å; L155-Q158 WeakPolarHBondContact O-CB 3.32Å; L155-Q158 PolarHBondContact O-N 3.42Å; L155-A159 PolarHBondContact O-N 3.17Å; L155-S182 WeakPolarHBondContact CD2-OG 3.42Å; L155-D187 WeakPolarHBondContact CD2-OD1 3.45Å; L155-N250 HydrophobicContact CB-CB 4.44Å |
| 156 | A | 97.8 | Very high | 95.5 | Very high | 3 Ų | 3 | 26.1 Ų | 26.1 | 3% | 0.025 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -62.6 | -44.9 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | N152 F153 Q158 A159 V160 L247 N250 L251 | N152-A156 WeakPolarHBondContact O-CB 3.34Å; N152-A156 PolarHBondContact O-N 3.02Å; F153-A156 WeakPolarHBondContact O-CB 3.46Å; F153-A156 PolarHBondContact O-N 3.29Å; A156-Q158 VanDerWaalsContact C-N 3.32Å; A156-Q158 PolarHBondContact O-N 2.88Å; A156-A159 WeakPolarHBondContact O-CB 3.31Å; A156-A159 PolarHBondContact O-N 2.98Å; A156-A159 VanDerWaalsContact O-N 3.11Å; A156-V160 WeakPolarHBondContact O-CG2 3.31Å; A156-V160 PolarHBondContact O-N 3.11Å; A156-L247 HydrophobicContact CB-CD1 3.71Å; A156-L247 WeakPolarHBondContact O-CD1 3.45Å; A156-N250 HydrophobicContact CB-CB 3.95Å; A156-L251 HydrophobicContact CB-CD2 3.77Å; A156-L251 HydrophobicContact CB-CG 3.99Å |
| 157 | L | 97.4 | Very high | 95.9 | Very high | 66 Ų | 66 | 29.1 Ų | 29.1 | 35% | 0.346 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -62.6 | -39.7 | 177 | -176.4 | 59.1 | 0 | 0 | 0 | 111.8 | F153 G154 V160 V161 L181 | F153-L157 PolarHBondContact O-N 3.43Å; G154-L157 PolarHBondContact O-N 3.31Å; L157-V160 WeakPolarHBondContact O-CB 3.38Å; L157-V160 PolarHBondContact O-N 2.97Å; L157-V161 WeakPolarHBondContact O-CG2 3.18Å; L157-V161 PolarHBondContact O-N 2.56Å; L157-L181 HydrophobicContact CD2-CB 4.12Å; L157-L181 HydrophobicContact CD2-CD1 3.9Å; L157-L181 HydrophobicContact CD2-CD2 4.27Å; L157-L181 HydrophobicContact CD2-CG 4.32Å; L157-L181 HydrophobicContact CG-CD1 4.05Å |
| 158 | Q | 97.4 | Very high | 96.2 | Very high | 3 Ų | 3 | 34.6 Ų | 34.6 | 1% | 0.014 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -58.3 | -47 | 171 | 177.9 | -176.1 | 1.7 | 0 | 0 | 111.3 | G154 L155 A156 V160 V161 Y162 G178 R179 S182 | G154-Q158 WeakPolarHBondContact O-CB 3.23Å; G154-Q158 PolarHBondContact O-N 3.24Å; L155-Q158 WeakPolarHBondContact O-CB 3.32Å; L155-Q158 PolarHBondContact O-N 3.42Å; A156-Q158 VanDerWaalsContact C-N 3.32Å; A156-Q158 PolarHBondContact O-N 2.88Å; Q158-V160 VanDerWaalsContact C-N 3.28Å; Q158-V160 PolarHBondContact O-N 3.05Å; Q158-V161 PolarHBondContact O-N 2.77Å; Q158-V161 VanDerWaalsContact O-N 3.17Å; Q158-Y162 HydrophobicContact CG-CD1 3.78Å; Q158-Y162 HydrophobicContact CG-CE1 3.45Å; Q158-Y162 VanDerWaalsContact CG-CE1 3.45Å; Q158-Y162 VanDerWaalsContact NE2-CZ 3.31Å; Q158-Y162 PolarHBondContact NE2-OH 2.67Å; Q158-Y162 VanDerWaalsContact NE2-OH 3.09Å; Q158-Y162 WeakPolarHBondContact O-CD1 3.09Å; Q158-Y162 PolarHBondContact O-N 3.37Å; Q158-G178 WeakPolarHBondContact CB-O 3.26Å; Q158-R179 VanDerWaalsContact NE2-CD 3.25Å; Q158-S182 VanDerWaalsContact OE1-CB 3.23Å; Q158-S182 PolarHBondContact OE1-OG 3.02Å |
| 159 | A | 97.4 | Very high | 96.2 | Very high | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.9 | -38.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L155 A156 Y162 L163 V246 L247 | L155-A159 PolarHBondContact O-N 3.17Å; A156-A159 WeakPolarHBondContact O-CB 3.31Å; A156-A159 PolarHBondContact O-N 2.98Å; A156-A159 VanDerWaalsContact O-N 3.11Å; A159-Y162 PolarHBondContact O-N 3.34Å; A159-L163 WeakPolarHBondContact O-CB 3.27Å; A159-L163 WeakPolarHBondContact O-CG 3.14Å; A159-L163 PolarHBondContact O-N 2.96Å; A159-V246 HydrophobicContact CB-CG1 3.8Å; A159-L247 HydrophobicContact CB-CB 4.03Å |
| 160 | V | 98.1 | Very high | 96.2 | Very high | 61 Ų | 61 | 42.2 Ų | 42.2 | 37% | 0.37 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -61.2 | -48.7 | 173.2 | 174.1 | 0 | 0 | 0 | 0 | 111.2 | A156 L157 Q158 Y162 L163 V164 L247 | A156-V160 WeakPolarHBondContact O-CG2 3.31Å; A156-V160 PolarHBondContact O-N 3.11Å; L157-V160 WeakPolarHBondContact O-CB 3.38Å; L157-V160 PolarHBondContact O-N 2.97Å; Q158-V160 VanDerWaalsContact C-N 3.28Å; Q158-V160 PolarHBondContact O-N 3.05Å; V160-Y162 VanDerWaalsContact C-N 3.28Å; V160-Y162 PolarHBondContact O-N 3.15Å; V160-L163 PolarHBondContact O-N 2.92Å; V160-V164 WeakPolarHBondContact O-CG2 3.15Å; V160-V164 PolarHBondContact O-N 3.41Å; V160-L247 HydrophobicContact CG2-CD1 3.83Å; V160-L247 HydrophobicContact CG2-CD2 3.9Å |
| 161 | V | 97.6 | Very high | 96.1 | Very high | 28 Ų | 28 | 42.8 Ų | 42.8 | 17% | 0.17 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -58.5 | -43.8 | 177.3 | 174 | 0 | 0 | 0 | 0 | 110.5 | L157 Q158 V164 V165 L181 | L157-V161 WeakPolarHBondContact O-CG2 3.18Å; L157-V161 PolarHBondContact O-N 2.56Å; Q158-V161 PolarHBondContact O-N 2.77Å; Q158-V161 VanDerWaalsContact O-N 3.17Å; V161-V164 PolarHBondContact O-N 2.86Å; V161-V165 HydrophobicContact CG1-CG2 4.49Å; V161-V165 VanDerWaalsContact O-CG2 3.31Å; V161-V165 WeakPolarHBondContact O-CG2 3.29Å; V161-V165 PolarHBondContact O-N 3.33Å; V161-L181 HydrophobicContact CG2-CD1 4.14Å |
| 162 | Y | 96.9 | Very high | 96 | Very high | 1 Ų | 1 | 43.5 Ų | 43.5 | 0% | 0.004 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -63.7 | -43.3 | 179.6 | -79.4 | 39.9 | 0 | 0 | 0 | 111.4 | T73 Q158 A159 V160 V164 V165 M166 F175 R179 F243 | T73-Y162 HydrophobicContact CG2-CE2 3.8Å; Q158-Y162 HydrophobicContact CG-CD1 3.78Å; Q158-Y162 HydrophobicContact CG-CE1 3.45Å; Q158-Y162 VanDerWaalsContact CG-CE1 3.45Å; Q158-Y162 VanDerWaalsContact NE2-CZ 3.31Å; Q158-Y162 PolarHBondContact NE2-OH 2.67Å; Q158-Y162 VanDerWaalsContact NE2-OH 3.09Å; Q158-Y162 WeakPolarHBondContact O-CD1 3.09Å; Q158-Y162 PolarHBondContact O-N 3.37Å; A159-Y162 PolarHBondContact O-N 3.34Å; V160-Y162 VanDerWaalsContact C-N 3.28Å; V160-Y162 PolarHBondContact O-N 3.15Å; Y162-V164 PolarHBondContact O-N 2.88Å; Y162-V165 PolarHBondContact O-N 3.46Å; Y162-M166 VanDerWaalsContact O-CG 3.28Å; Y162-M166 WeakPolarHBondContact O-CG 3.45Å; Y162-M166 PolarHBondContact O-N 3.13Å; Y162-F175 AromaticContact CD1-CD1 3.49Å; Y162-F175 HydrophobicContact CD1-CD1 3.49Å; Y162-F175 VanDerWaalsContact CD1-CD1 3.49Å; Y162-F175 HydrophobicContact CD1-CE1 4.04Å; Y162-F175 AromaticContact CD2-CD1 3.46Å; Y162-F175 HydrophobicContact CD2-CD1 3.46Å; Y162-F175 VanDerWaalsContact CD2-CD1 3.46Å; Y162-F175 AromaticContact CD2-CE1 3.43Å; Y162-F175 HydrophobicContact CD2-CE1 3.43Å; Y162-F175 VanDerWaalsContact CD2-CE1 3.43Å; Y162-F175 HydrophobicContact CE1-CB 4.16Å; Y162-F175 AromaticContact CE1-CD1 3.54Å; Y162-F175 HydrophobicContact CE1-CD1 3.54Å; Y162-F175 HydrophobicContact CE1-CE1 4.44Å; Y162-F175 HydrophobicContact CE1-CG 4.35Å; Y162-F175 WeakPolarHBondContact CE1-O 3.44Å; Y162-F175 AromaticContact CE2-CD1 3.51Å; Y162-F175 HydrophobicContact CE2-CD1 3.51Å; Y162-F175 AromaticContact CE2-CE1 3.9Å; Y162-F175 HydrophobicContact CE2-CE1 3.9Å; Y162-F175 HydrophobicContact CE2-CG 4.49Å; Y162-F175 AromaticContact CG-CD1 3.45Å; Y162-F175 HydrophobicContact CG-CD1 3.45Å; Y162-F175 VanDerWaalsContact CG-CD1 3.45Å; Y162-F175 AromaticContact CG-CE1 3.52Å; Y162-F175 HydrophobicContact CG-CE1 3.52Å; Y162-F175 AromaticContact CZ-CD1 3.54Å; Y162-R179 WeakPolarHBondContact OH-CG 3.42Å; Y162-F243 HydrophobicContact CD2-CD1 4.34Å; Y162-F243 AromaticContact CD2-CE1 3.5Å; Y162-F243 HydrophobicContact CD2-CE1 3.5Å; Y162-F243 VanDerWaalsContact CD2-CE1 3.5Å; Y162-F243 HydrophobicContact CD2-CZ 4.09Å; Y162-F243 HydrophobicContact CE2-CE1 4.4Å; Y162-F243 HydrophobicContact CG-CE1 4.23Å |
| 163 | L | 97.4 | Very high | 95.8 | Very high | 6 Ų | 6 | 47.1 Ų | 47.1 | 3% | 0.031 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -59.2 | -46.5 | 174 | -77.6 | 166.5 | 0 | 0 | 0 | 111.5 | A159 V160 V165 M166 Y167 I240 F243 W244 L247 | A159-L163 WeakPolarHBondContact O-CB 3.27Å; A159-L163 WeakPolarHBondContact O-CG 3.14Å; A159-L163 PolarHBondContact O-N 2.96Å; V160-L163 PolarHBondContact O-N 2.92Å; L163-V165 VanDerWaalsContact C-N 3.32Å; L163-V165 PolarHBondContact O-N 3.24Å; L163-M166 PolarHBondContact O-N 3.44Å; L163-M166 VanDerWaalsContact O-N 3.14Å; L163-Y167 HydrophobicContact CB-CD2 4.43Å; L163-Y167 HydrophobicContact CB-CE2 4.5Å; L163-Y167 HydrophobicContact CD2-CE2 4.22Å; L163-Y167 WeakPolarHBondContact O-CD2 3.37Å; L163-Y167 PolarHBondContact O-N 3.26Å; L163-I240 HydrophobicContact CD2-CG2 4.08Å; L163-F243 HydrophobicContact CD2-CB 3.6Å; L163-F243 HydrophobicContact CG-CB 3.98Å; L163-W244 HydrophobicContact CD1-CD2 3.83Å; L163-W244 HydrophobicContact CD1-CE3 4.1Å; L163-W244 HydrophobicContact CD1-CG 4.22Å; L163-W244 HydrophobicContact CD1-CH2 4.5Å; L163-W244 HydrophobicContact CD1-CZ2 4.26Å; L163-W244 HydrophobicContact CD1-CZ3 4.42Å; L163-W244 HydrophobicContact CD2-CD2 4.49Å; L163-W244 HydrophobicContact CD2-CG 4.24Å; L163-L247 HydrophobicContact CD1-CD2 4.18Å |
| 164 | V | 97.4 | Very high | 95.8 | Very high | 65 Ų | 65 | 43 Ų | 43 | 39% | 0.394 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -59 | -44.5 | 177.1 | 172.9 | 0 | 0 | 0 | 0 | 110.9 | V160 V161 Y162 M166 Y167 L168 L170 | V160-V164 WeakPolarHBondContact O-CG2 3.15Å; V160-V164 PolarHBondContact O-N 3.41Å; V161-V164 PolarHBondContact O-N 2.86Å; Y162-V164 PolarHBondContact O-N 2.88Å; V164-M166 VanDerWaalsContact C-N 3.31Å; V164-M166 PolarHBondContact O-N 3.3Å; V164-Y167 PolarHBondContact O-N 3.29Å; V164-L168 HydrophobicContact CG1-CD1 3.78Å; V164-L168 HydrophobicContact CG1-CG 4.4Å; V164-L168 WeakPolarHBondContact O-CB 3.49Å; V164-L168 PolarHBondContact O-N 2.9Å; V164-L170 HydrophobicContact CG1-CD1 4.11Å |
| 165 | V | 96.2 | Very high | 95.7 | Very high | 1 Ų | 1 | 42.8 Ų | 42.8 | 1% | 0.006 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.4 | -42.8 | 175.8 | 171.9 | 0 | 0 | 0 | 0 | 111.4 | V161 Y162 L163 K169 L170 C174 F175 | V161-V165 HydrophobicContact CG1-CG2 4.49Å; V161-V165 VanDerWaalsContact O-CG2 3.31Å; V161-V165 WeakPolarHBondContact O-CG2 3.29Å; V161-V165 PolarHBondContact O-N 3.33Å; Y162-V165 PolarHBondContact O-N 3.46Å; L163-V165 VanDerWaalsContact C-N 3.32Å; L163-V165 PolarHBondContact O-N 3.24Å; V165-K169 CarbonylContact O-C 3.56Å; V165-K169 WeakPolarHBondContact O-CA 3.43Å; V165-K169 PolarHBondContact O-N 3.42Å; V165-L170 HydrophobicContact CB-CB 4.41Å; V165-L170 HydrophobicContact CG1-CB 4.24Å; V165-L170 HydrophobicContact CG2-CB 4.25Å; V165-L170 HydrophobicContact CG2-CD1 4.33Å; V165-L170 PolarHBondContact O-N 3.19Å; V165-C174 HydrophobicContact CG2-CB 3.36Å; V165-F175 HydrophobicContact CB-CE1 4.32Å; V165-F175 HydrophobicContact CB-CZ 4.25Å; V165-F175 HydrophobicContact CG1-CD2 4.15Å; V165-F175 HydrophobicContact CG1-CE1 4.14Å; V165-F175 HydrophobicContact CG1-CE2 3.63Å; V165-F175 HydrophobicContact CG1-CZ 3.62Å |
| 166 | M | 94.8 | Very high | 95.7 | Very high | 10 Ų | 10 | 45 Ų | 45 | 5% | 0.049 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -69.6 | -43.2 | -179.8 | -68.4 | 180 | -172.4 | 0 | 0 | 113.2 | Y76 Y162 L163 V164 F175 I240 F243 | Y76-M166 HydrophobicContact CD1-CE 4.29Å; Y76-M166 HydrophobicContact CD2-CE 4.23Å; Y76-M166 HydrophobicContact CD2-CG 4.27Å; Y76-M166 HydrophobicContact CD2-SD 4.47Å; Y76-M166 HydrophobicContact CE1-CG 4.25Å; Y76-M166 HydrophobicContact CE2-CB 4.45Å; Y76-M166 HydrophobicContact CE2-CG 3.8Å; Y76-M166 HydrophobicContact CG-CE 4.04Å; Y162-M166 VanDerWaalsContact O-CG 3.28Å; Y162-M166 WeakPolarHBondContact O-CG 3.45Å; Y162-M166 PolarHBondContact O-N 3.13Å; L163-M166 PolarHBondContact O-N 3.44Å; L163-M166 VanDerWaalsContact O-N 3.14Å; V164-M166 VanDerWaalsContact C-N 3.31Å; V164-M166 PolarHBondContact O-N 3.3Å; M166-F175 HydrophobicContact CE-CE1 4.15Å; M166-F175 HydrophobicContact CE-CZ 4.11Å; M166-I240 HydrophobicContact CB-CG1 4.23Å; M166-F243 HydrophobicContact CE-CD1 4.35Å; M166-F243 HydrophobicContact CE-CD2 3.56Å; M166-F243 HydrophobicContact CE-CE1 4.07Å; M166-F243 HydrophobicContact CE-CE2 3.22Å; M166-F243 HydrophobicContact CE-CG 4.12Å; M166-F243 HydrophobicContact CE-CZ 3.49Å; M166-F243 VanDerWaalsContact CE-CZ 3.49Å; M166-F243 HydrophobicContact SD-CD2 3.69Å; M166-F243 HydrophobicContact SD-CE2 3.99Å; M166-F243 HydrophobicContact SD-CG 4.15Å |
| 167 | Y | 95.6 | Very high | 95.6 | Very high | 126 Ų | 126 | 48.4 Ų | 48.4 | 49% | 0.494 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -68.2 | -46.6 | 179.3 | -83.8 | -68.4 | 0 | 0 | 0 | 112.4 | L163 V164 K169 I240 W244 | L163-Y167 HydrophobicContact CB-CD2 4.43Å; L163-Y167 HydrophobicContact CB-CE2 4.5Å; L163-Y167 HydrophobicContact CD2-CE2 4.22Å; L163-Y167 WeakPolarHBondContact O-CD2 3.37Å; L163-Y167 PolarHBondContact O-N 3.26Å; V164-Y167 PolarHBondContact O-N 3.29Å; Y167-K169 VanDerWaalsContact C-N 3.28Å; Y167-I240 HydrophobicContact CD1-CD1 4.05Å; Y167-I240 HydrophobicContact CE1-CD1 3.97Å; Y167-I240 HydrophobicContact CE1-CG2 3.93Å; Y167-I240 HydrophobicContact CE2-CG2 3.7Å; Y167-I240 WeakPolarHBondContact OH-CG2 3.33Å; Y167-W244 HydrophobicContact CE2-CZ2 4.4Å; Y167-W244 AromaticContact CE2-NE1 3.82Å; Y167-W244 AromaticContact CZ-NE1 3.89Å; Y167-W244 PolarHBondContact OH-NE1 3.41Å |
| 168 | L | 94.9 | Very high | 95.5 | Very high | 119 Ų | 119 | 45.3 Ų | 45.3 | 62% | 0.623 | 24% | 0.243 | S | C | * | . | H | α-helix | trans | -86.7 | -1.3 | -177.1 | -61.2 | -177 | 0 | 0 | 0 | 112.7 | V164 L170 | V164-L168 HydrophobicContact CG1-CD1 3.78Å; V164-L168 HydrophobicContact CG1-CG 4.4Å; V164-L168 WeakPolarHBondContact O-CB 3.49Å; V164-L168 PolarHBondContact O-N 2.9Å; L168-L170 HydrophobicContact CB-CD1 4.34Å; L168-L170 HydrophobicContact CB-CD2 4.15Å; L168-L170 HydrophobicContact CB-CG 3.81Å; L168-L170 HydrophobicContact CD1-CD1 4.38Å; L168-L170 PolarHBondContact O-N 3.33Å |
| 169 | K | 91.3 | Very high | 95.4 | Very high | 142 Ų | 142 | 47.1 Ų | 47.1 | 62% | 0.617 | 25% | 0.25 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 50.6 | 39.9 | -176.5 | -63.2 | -174 | 179 | -174.3 | 0 | 112.5 | R80 V165 Y167 | R80-K169 PolarHBondContact NH2-O 3.41Å; R80-K169 VanDerWaalsContact NH2-O 3.17Å; V165-K169 CarbonylContact O-C 3.56Å; V165-K169 WeakPolarHBondContact O-CA 3.43Å; V165-K169 PolarHBondContact O-N 3.42Å; Y167-K169 VanDerWaalsContact C-N 3.28Å |
| 170 | L | 93.3 | Very high | 95.3 | Very high | 59 Ų | 59 | 50.1 Ų | 50.1 | 31% | 0.309 | 27% | 0.265 | S | S | . | . | trans | -63.7 | 162 | -179.3 | -67.9 | 177.7 | 0 | 0 | 0 | 111.8 | V164 V165 L168 | V164-L170 HydrophobicContact CG1-CD1 4.11Å; V165-L170 HydrophobicContact CB-CB 4.41Å; V165-L170 HydrophobicContact CG1-CB 4.24Å; V165-L170 HydrophobicContact CG2-CB 4.25Å; V165-L170 HydrophobicContact CG2-CD1 4.33Å; V165-L170 PolarHBondContact O-N 3.19Å; L168-L170 HydrophobicContact CB-CD1 4.34Å; L168-L170 HydrophobicContact CB-CD2 4.15Å; L168-L170 HydrophobicContact CB-CG 3.81Å; L168-L170 HydrophobicContact CD1-CD1 4.38Å; L168-L170 PolarHBondContact O-N 3.33Å | ||
| 171 | P | 92.8 | Very high | 95.2 | Very high | 81 Ų | 81 | 50 Ų | 50 | 53% | 0.526 | 26% | 0.263 | S | S | . | . | trans | -58.3 | 145.7 | 174.9 | 23.7 | -35.2 | 0 | 0 | 0 | 111.9 | V173 C174 | P171-V173 PolarHBondContact O-N 3.18Å; P171-C174 WeakPolarHBondContact O-CB 3.4Å; P171-C174 PolarHBondContact O-N 2.84Å | ||
| 172 | V | 93 | Very high | 95.1 | Very high | 14 Ų | 14 | 48.7 Ų | 48.7 | 9% | 0.085 | 26% | 0.255 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -53.5 | -30.6 | -179 | 171.6 | 0 | 0 | 0 | 0 | 113 | L77 W116 C174 F175 | L77-V172 HydrophobicContact CD2-CB 4.3Å; L77-V172 HydrophobicContact CD2-CG1 3.26Å; L77-V172 HydrophobicContact CD2-CG2 4.11Å; W116-V172 HydrophobicContact CB-CG1 4.1Å; W116-V172 HydrophobicContact CD2-CB 4.28Å; W116-V172 HydrophobicContact CD2-CG1 3.46Å; W116-V172 VanDerWaalsContact CD2-CG1 3.46Å; W116-V172 HydrophobicContact CE3-CG1 3.76Å; W116-V172 HydrophobicContact CG-CG1 3.61Å; W116-V172 HydrophobicContact CZ3-CG1 4.49Å; V172-C174 PolarHBondContact O-N 3.11Å; V172-F175 HydrophobicContact CG1-CD2 4.23Å; V172-F175 WeakPolarHBondContact O-CB 3.48Å; V172-F175 WeakPolarHBondContact O-CD2 3.36Å; V172-F175 PolarHBondContact O-N 2.87Å |
| 173 | V | 93.9 | Very high | 94.9 | Very high | 76 Ų | 76 | 48.7 Ų | 48.7 | 46% | 0.461 | 25% | 0.254 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50.3 | -34.3 | 175.8 | -175.4 | 0 | 0 | 0 | 0 | 111.9 | W116 P171 F175 L176 | W116-V173 HydrophobicContact CH2-CB 4.09Å; W116-V173 HydrophobicContact CH2-CG2 3.31Å; W116-V173 HydrophobicContact CZ2-CG2 3.98Å; W116-V173 HydrophobicContact CZ3-CB 4.34Å; W116-V173 HydrophobicContact CZ3-CG2 4.03Å; P171-V173 PolarHBondContact O-N 3.18Å; V173-F175 PolarHBondContact O-N 3.39Å; V173-L176 WeakPolarHBondContact O-CB 3.38Å; V173-L176 PolarHBondContact O-N 3.03Å |
| 174 | C | 95.3 | Very high | 94.7 | Very high | 36 Ų | 36 | 53.3 Ų | 53.3 | 24% | 0.243 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -64.5 | -21.8 | -177.9 | -67.4 | 0 | 0 | 0 | 0 | 113.7 | V165 P171 V172 L176 V177 | V165-C174 HydrophobicContact CG2-CB 3.36Å; P171-C174 WeakPolarHBondContact O-CB 3.4Å; P171-C174 PolarHBondContact O-N 2.84Å; V172-C174 PolarHBondContact O-N 3.11Å; C174-L176 PolarHBondContact O-N 3.27Å; C174-V177 WeakPolarHBondContact O-CB 3.23Å; C174-V177 PolarHBondContact O-N 3.07Å |
| 175 | F | 95.4 | Very high | 94.6 | Very high | 0 Ų | 0 | 50.7 Ų | 50.7 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61.7 | -29.7 | 171.3 | -74 | -65.8 | 0 | 0 | 0 | 112.4 | Y76 L77 I120 Y162 V165 M166 V172 V173 V177 G178 R179 | Y76-F175 AromaticContact CD1-CE2 3.69Å; Y76-F175 HydrophobicContact CD1-CE2 3.69Å; Y76-F175 AromaticContact CD1-CZ 3.5Å; Y76-F175 HydrophobicContact CD1-CZ 3.5Å; Y76-F175 VanDerWaalsContact CD1-CZ 3.5Å; Y76-F175 AromaticContact CE1-CE2 3.58Å; Y76-F175 HydrophobicContact CE1-CE2 3.58Å; Y76-F175 AromaticContact CE1-CZ 3.46Å; Y76-F175 HydrophobicContact CE1-CZ 3.46Å; Y76-F175 VanDerWaalsContact CE1-CZ 3.46Å; L77-F175 HydrophobicContact CD2-CD2 3.99Å; L77-F175 HydrophobicContact CD2-CE2 4.09Å; I120-F175 HydrophobicContact CD1-CB 3.64Å; I120-F175 HydrophobicContact CD1-CG 4.37Å; I120-F175 HydrophobicContact CG1-CB 4.09Å; Y162-F175 AromaticContact CD1-CD1 3.49Å; Y162-F175 HydrophobicContact CD1-CD1 3.49Å; Y162-F175 VanDerWaalsContact CD1-CD1 3.49Å; Y162-F175 HydrophobicContact CD1-CE1 4.04Å; Y162-F175 AromaticContact CD2-CD1 3.46Å; Y162-F175 HydrophobicContact CD2-CD1 3.46Å; Y162-F175 VanDerWaalsContact CD2-CD1 3.46Å; Y162-F175 AromaticContact CD2-CE1 3.43Å; Y162-F175 HydrophobicContact CD2-CE1 3.43Å; Y162-F175 VanDerWaalsContact CD2-CE1 3.43Å; Y162-F175 HydrophobicContact CE1-CB 4.16Å; Y162-F175 AromaticContact CE1-CD1 3.54Å; Y162-F175 HydrophobicContact CE1-CD1 3.54Å; Y162-F175 HydrophobicContact CE1-CE1 4.44Å; Y162-F175 HydrophobicContact CE1-CG 4.35Å; Y162-F175 WeakPolarHBondContact CE1-O 3.44Å; Y162-F175 AromaticContact CE2-CD1 3.51Å; Y162-F175 HydrophobicContact CE2-CD1 3.51Å; Y162-F175 AromaticContact CE2-CE1 3.9Å; Y162-F175 HydrophobicContact CE2-CE1 3.9Å; Y162-F175 HydrophobicContact CE2-CG 4.49Å; Y162-F175 AromaticContact CG-CD1 3.45Å; Y162-F175 HydrophobicContact CG-CD1 3.45Å; Y162-F175 VanDerWaalsContact CG-CD1 3.45Å; Y162-F175 AromaticContact CG-CE1 3.52Å; Y162-F175 HydrophobicContact CG-CE1 3.52Å; Y162-F175 AromaticContact CZ-CD1 3.54Å; V165-F175 HydrophobicContact CB-CE1 4.32Å; V165-F175 HydrophobicContact CB-CZ 4.25Å; V165-F175 HydrophobicContact CG1-CD2 4.15Å; V165-F175 HydrophobicContact CG1-CE1 4.14Å; V165-F175 HydrophobicContact CG1-CE2 3.63Å; V165-F175 HydrophobicContact CG1-CZ 3.62Å; M166-F175 HydrophobicContact CE-CE1 4.15Å; M166-F175 HydrophobicContact CE-CZ 4.11Å; V172-F175 HydrophobicContact CG1-CD2 4.23Å; V172-F175 WeakPolarHBondContact O-CB 3.48Å; V172-F175 WeakPolarHBondContact O-CD2 3.36Å; V172-F175 PolarHBondContact O-N 2.87Å; V173-F175 PolarHBondContact O-N 3.39Å; F175-V177 VanDerWaalsContact C-N 3.29Å; F175-V177 PolarHBondContact O-N 3.4Å; F175-G178 PolarHBondContact O-N 3.44Å; F175-R179 PolarHBondContact O-N 3.11Å; F175-R179 VanDerWaalsContact O-N 3.11Å |
| 176 | L | 95.4 | Very high | 94.2 | Very high | 47 Ų | 47 | 50.6 Ų | 50.6 | 25% | 0.246 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60.6 | -39.8 | 176.1 | -174.2 | 63.6 | 0 | 0 | 0 | 111.5 | Y119 V173 C174 G178 R179 L180 | Y119-L176 VanDerWaalsContact O-CD1 3.26Å; Y119-L176 WeakPolarHBondContact O-CD1 3.22Å; V173-L176 WeakPolarHBondContact O-CB 3.38Å; V173-L176 PolarHBondContact O-N 3.03Å; C174-L176 PolarHBondContact O-N 3.27Å; L176-G178 VanDerWaalsContact C-N 3.33Å; L176-G178 PolarHBondContact O-N 2.93Å; L176-R179 PolarHBondContact O-N 3.18Å; L176-L180 HydrophobicContact CG-CD1 4.12Å; L176-L180 HydrophobicContact CG-CG 4.37Å; L176-L180 VanDerWaalsContact O-CG 3.31Å; L176-L180 WeakPolarHBondContact O-CG 3.45Å; L176-L180 PolarHBondContact O-N 3.44Å |
| 177 | V | 96.1 | Very high | 94 | Very high | 76 Ų | 76 | 50.5 Ų | 50.5 | 46% | 0.461 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60.2 | -46 | 178.4 | -180 | 0 | 0 | 0 | 0 | 110.3 | C174 F175 R179 L180 L181 | C174-V177 WeakPolarHBondContact O-CB 3.23Å; C174-V177 PolarHBondContact O-N 3.07Å; F175-V177 VanDerWaalsContact C-N 3.29Å; F175-V177 PolarHBondContact O-N 3.4Å; V177-R179 VanDerWaalsContact C-N 3.33Å; V177-R179 PolarHBondContact O-N 2.92Å; V177-L180 PolarHBondContact O-N 3.15Å; V177-L181 HydrophobicContact CG1-CD1 4.09Å; V177-L181 VanDerWaalsContact O-CG 3.28Å; V177-L181 WeakPolarHBondContact O-CG 3.39Å; V177-L181 PolarHBondContact O-N 3.19Å |
| 178 | G | 95.3 | Very high | 93.8 | Very high | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -60.3 | -42.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q158 F175 L176 L181 S182 | Q158-G178 WeakPolarHBondContact CB-O 3.26Å; F175-G178 PolarHBondContact O-N 3.44Å; L176-G178 VanDerWaalsContact C-N 3.33Å; L176-G178 PolarHBondContact O-N 2.93Å; G178-L181 PolarHBondContact O-N 3.48Å; G178-S182 PolarHBondContact O-N 2.97Å |
| 179 | R | 95.1 | Very high | 93.4 | Very high | 41 Ų | 41 | 40.8 Ų | 40.8 | 16% | 0.155 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -65.6 | -41.7 | 176.4 | -83.9 | -66.8 | -161 | 116 | 20.5 | 113.8 | I120 S121 Q158 Y162 F175 L176 V177 L181 S182 G183 | I120-R179 HydrophobicContact CG2-CB 4.49Å; I120-R179 HydrophobicContact CG2-CG 3.45Å; I120-R179 VanDerWaalsContact CG2-CG 3.45Å; I120-R179 WeakPolarHBondContact O-CG 3.38Å; S121-R179 PolarHBondContact OG-NH2 3.06Å; Q158-R179 VanDerWaalsContact NE2-CD 3.25Å; Y162-R179 WeakPolarHBondContact OH-CG 3.42Å; F175-R179 PolarHBondContact O-N 3.11Å; F175-R179 VanDerWaalsContact O-N 3.11Å; L176-R179 PolarHBondContact O-N 3.18Å; V177-R179 VanDerWaalsContact C-N 3.33Å; V177-R179 PolarHBondContact O-N 2.92Å; R179-L181 VanDerWaalsContact C-N 3.31Å; R179-L181 PolarHBondContact O-N 2.95Å; R179-S182 PolarHBondContact O-N 2.82Å; R179-G183 PolarHBondContact O-N 2.89Å |
| 180 | L | 95.7 | Very high | 93.3 | Very high | 63 Ų | 63 | 34.1 Ų | 34.1 | 33% | 0.33 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -61.5 | -42.6 | 176.3 | -70.4 | 170 | 0 | 0 | 0 | 110.8 | G123 V127 L176 V177 G183 L184 | G123-L180 WeakPolarHBondContact O-CD2 3.41Å; V127-L180 HydrophobicContact CG2-CD2 3.6Å; L176-L180 HydrophobicContact CG-CD1 4.12Å; L176-L180 HydrophobicContact CG-CG 4.37Å; L176-L180 VanDerWaalsContact O-CG 3.31Å; L176-L180 WeakPolarHBondContact O-CG 3.45Å; L176-L180 PolarHBondContact O-N 3.44Å; V177-L180 PolarHBondContact O-N 3.15Å; L180-G183 PolarHBondContact O-N 3.26Å; L180-L184 WeakPolarHBondContact O-CG 3.32Å; L180-L184 PolarHBondContact O-N 3.33Å |
| 181 | L | 95.5 | Very high | 93.2 | Very high | 60 Ų | 60 | 31.3 Ų | 31.3 | 31% | 0.314 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -63.7 | -44.3 | 177.2 | -68.8 | 170.3 | 0 | 0 | 0 | 112.3 | L157 V161 V177 G178 R179 L184 S185 | L157-L181 HydrophobicContact CD2-CB 4.12Å; L157-L181 HydrophobicContact CD2-CD1 3.9Å; L157-L181 HydrophobicContact CD2-CD2 4.27Å; L157-L181 HydrophobicContact CD2-CG 4.32Å; L157-L181 HydrophobicContact CG-CD1 4.05Å; V161-L181 HydrophobicContact CG2-CD1 4.14Å; V177-L181 HydrophobicContact CG1-CD1 4.09Å; V177-L181 VanDerWaalsContact O-CG 3.28Å; V177-L181 WeakPolarHBondContact O-CG 3.39Å; V177-L181 PolarHBondContact O-N 3.19Å; G178-L181 PolarHBondContact O-N 3.48Å; R179-L181 VanDerWaalsContact C-N 3.31Å; R179-L181 PolarHBondContact O-N 2.95Å; L181-L184 PolarHBondContact O-N 3.4Å; L181-S185 PolarHBondContact O-N 2.87Å |
| 182 | S | 94.9 | Very high | 93.1 | Very high | 0 Ų | 0 | 28.6 Ų | 28.6 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -63.1 | -43.8 | 173.3 | -179 | 0 | 0 | 0 | 0 | 111.6 | L155 Q158 G178 R179 L184 S185 G186 D187 | L155-S182 WeakPolarHBondContact CD2-OG 3.42Å; Q158-S182 VanDerWaalsContact OE1-CB 3.23Å; Q158-S182 PolarHBondContact OE1-OG 3.02Å; G178-S182 PolarHBondContact O-N 2.97Å; R179-S182 PolarHBondContact O-N 2.82Å; S182-L184 VanDerWaalsContact C-N 3.33Å; S182-L184 PolarHBondContact O-N 3.38Å; S182-S185 WeakPolarHBondContact O-CA 3.4Å; S182-S185 WeakPolarHBondContact O-CB 3.3Å; S182-S185 PolarHBondContact O-N 3.01Å; S182-S185 PolarHBondContact O-OG 3.36Å; S182-G186 PolarHBondContact O-N 2.66Å; S182-D187 PolarHBondContact O-N 2.91Å; S182-D187 PolarHBondContact OG-OD1 3.49Å |
| 183 | G | 93.4 | Very high | 92.6 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -58 | -41.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | R179 L180 S185 G186 | R179-G183 PolarHBondContact O-N 2.89Å; L180-G183 PolarHBondContact O-N 3.26Å; G183-S185 PolarHBondContact O-N 3.45Å; G183-G186 PolarHBondContact O-N 3.18Å; G183-G186 VanDerWaalsContact O-N 3.08Å |
| 184 | L | 94.2 | Very high | 92.3 | Very high | 104 Ų | 104 | 26 Ų | 26 | 55% | 0.545 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -62.8 | -23.9 | 175.6 | -75.4 | 174 | 0 | 0 | 0 | 113.4 | V127 I131 L180 L181 S182 | V127-L184 HydrophobicContact CG1-CB 4.37Å; V127-L184 HydrophobicContact CG1-CD2 3.58Å; V127-L184 HydrophobicContact CG1-CG 3.8Å; I131-L184 WeakPolarHBondContact CG2-O 3.23Å; L180-L184 WeakPolarHBondContact O-CG 3.32Å; L180-L184 PolarHBondContact O-N 3.33Å; L181-L184 PolarHBondContact O-N 3.4Å; S182-L184 VanDerWaalsContact C-N 3.33Å; S182-L184 PolarHBondContact O-N 3.38Å |
| 185 | S | 93.8 | Very high | 92 | Very high | 9 Ų | 9 | 24.3 Ų | 24.3 | 6% | 0.063 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -92.3 | -6.1 | 177.1 | 75.4 | 0 | 0 | 0 | 0 | 113.9 | L135 P151 G154 L181 S182 G183 | L135-S185 VanDerWaalsContact CD1-O 3.31Å; L135-S185 WeakPolarHBondContact CD1-O 3.34Å; P151-S185 WeakPolarHBondContact CA-O 3.36Å; P151-S185 WeakPolarHBondContact CA-OG 3.11Å; P151-S185 WeakPolarHBondContact CB-O 3.48Å; P151-S185 VanDerWaalsContact CG-O 3.31Å; P151-S185 WeakPolarHBondContact CG-O 3.35Å; G154-S185 WeakPolarHBondContact CA-OG 3.48Å; L181-S185 PolarHBondContact O-N 2.87Å; S182-S185 WeakPolarHBondContact O-CA 3.4Å; S182-S185 WeakPolarHBondContact O-CB 3.3Å; S182-S185 PolarHBondContact O-N 3.01Å; S182-S185 PolarHBondContact O-OG 3.36Å; G183-S185 PolarHBondContact O-N 3.45Å |
| 186 | G | 87.8 | Confident | 91.5 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 14% | 0.144 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 103.3 | -4.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | V132 S182 G183 A190 | V132-G186 WeakPolarHBondContact CG2-O 3.47Å; S182-G186 PolarHBondContact O-N 2.66Å; G183-G186 PolarHBondContact O-N 3.18Å; G183-G186 VanDerWaalsContact O-N 3.08Å; G186-A190 VanDerWaalsContact O-CB 3.29Å; G186-A190 WeakPolarHBondContact O-CB 3.33Å; G186-A190 PolarHBondContact O-N 3.32Å |
| 187 | D | 91.3 | Very high | 90.8 | Very high | 8 Ų | 8 | 26.6 Ų | 26.6 | 4% | 0.043 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | 51.7 | -167.5 | -179.5 | -155.3 | -8.4 | 0 | 0 | 0 | 112.8 | P151 L155 S182 N189 A190 | P151-D187 WeakPolarHBondContact CB-O 3.31Å; L155-D187 WeakPolarHBondContact CD2-OD1 3.45Å; S182-D187 PolarHBondContact O-N 2.91Å; S182-D187 PolarHBondContact OG-OD1 3.49Å; D187-N189 PolarHBondContact O-N 3.18Å; D187-A190 PolarHBondContact O-N 2.99Å |
| 188 | F | 90.7 | Very high | 90.3 | Very high | 18 Ų | 18 | 23.7 Ų | 23.7 | 8% | 0.079 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -58 | -27.6 | 174.8 | 179.6 | -106.2 | 0 | 0 | 0 | 113.3 | L59 M63 L66 A190 V191 L192 L219 | L59-F188 HydrophobicContact CD1-CE2 4.36Å; L59-F188 HydrophobicContact CD1-CZ 4.24Å; M63-F188 HydrophobicContact CB-CE2 3.92Å; M63-F188 HydrophobicContact CB-CZ 4.02Å; M63-F188 HydrophobicContact CG-CZ 4.46Å; M63-F188 HydrophobicContact SD-CE1 4.35Å; M63-F188 HydrophobicContact SD-CE2 4.43Å; M63-F188 HydrophobicContact SD-CZ 3.91Å; L66-F188 HydrophobicContact CD2-CB 3.93Å; L66-F188 HydrophobicContact CD2-CD1 3.65Å; L66-F188 HydrophobicContact CD2-CD2 4.15Å; L66-F188 HydrophobicContact CD2-CE1 4.18Å; L66-F188 HydrophobicContact CD2-CG 3.63Å; F188-A190 PolarHBondContact O-N 3.47Å; F188-V191 WeakPolarHBondContact O-CB 3.31Å; F188-V191 PolarHBondContact O-N 3.34Å; F188-V191 VanDerWaalsContact O-N 3.15Å; F188-L192 HydrophobicContact CE1-CB 4.29Å; F188-L192 HydrophobicContact CE1-CD1 4.42Å; F188-L192 HydrophobicContact CE1-CD2 4.37Å; F188-L192 HydrophobicContact CZ-CD1 4.4Å; F188-L192 PolarHBondContact O-N 3.44Å; F188-L219 HydrophobicContact CZ-CD2 3.77Å |
| 189 | N | 87.4 | Confident | 89.8 | Confident | 22 Ų | 22 | 23.7 Ų | 23.7 | 12% | 0.118 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -65.2 | -39.8 | -175.6 | -62.8 | -9.1 | 0 | 0 | 0 | 112.5 | V132 D187 V191 L192 A193 F442 | V132-N189 HydrophobicContact CG1-CB 4.31Å; V132-N189 HydrophobicContact CG2-CB 4.08Å; D187-N189 PolarHBondContact O-N 3.18Å; N189-V191 VanDerWaalsContact C-N 3.34Å; N189-L192 PolarHBondContact O-N 3.1Å; N189-A193 WeakPolarHBondContact O-CB 3.06Å; N189-A193 PolarHBondContact O-N 3.1Å; N189-F442 VanDerWaalsContact ND2-CD2 3.31Å; N189-F442 WeakPolarHBondContact ND2-CD2 3.5Å; N189-F442 WeakPolarHBondContact ND2-CE2 3.42Å; N189-F442 WeakPolarHBondContact OD1-CE2 3.43Å |
| 190 | A | 88.9 | Confident | 89 | Confident | 3 Ų | 3 | 23.4 Ų | 23.4 | 3% | 0.025 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -66.4 | -36.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | V132 L135 P151 G186 D187 F188 G194 | V132-A190 HydrophobicContact CG2-CB 4.43Å; L135-A190 HydrophobicContact CD1-CB 4.31Å; P151-A190 HydrophobicContact CB-CB 4.18Å; P151-A190 HydrophobicContact CG-CB 3.55Å; G186-A190 VanDerWaalsContact O-CB 3.29Å; G186-A190 WeakPolarHBondContact O-CB 3.33Å; G186-A190 PolarHBondContact O-N 3.32Å; D187-A190 PolarHBondContact O-N 2.99Å; F188-A190 PolarHBondContact O-N 3.47Å; A190-G194 PolarHBondContact O-N 2.85Å |
| 191 | V | 92.3 | Very high | 88.3 | Confident | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -62.3 | -48.9 | 173.6 | -174.8 | 0 | 0 | 0 | 0 | 110.3 | V58 L148 P151 F188 N189 G194 C195 | V58-V191 HydrophobicContact CG1-CG1 4.03Å; L148-V191 HydrophobicContact CD2-CG1 4.48Å; P151-V191 HydrophobicContact CB-CG2 3.71Å; P151-V191 HydrophobicContact CG-CG2 4.04Å; F188-V191 WeakPolarHBondContact O-CB 3.31Å; F188-V191 PolarHBondContact O-N 3.34Å; F188-V191 VanDerWaalsContact O-N 3.15Å; N189-V191 VanDerWaalsContact C-N 3.34Å; V191-G194 PolarHBondContact O-N 2.71Å; V191-C195 WeakPolarHBondContact O-CB 3.46Å; V191-C195 PolarHBondContact O-N 3.11Å; V191-C195 PolarHBondContact O-SG 3.14Å |
| 192 | L | 88.9 | Confident | 87.7 | Confident | 23 Ų | 23 | 24.4 Ų | 24.4 | 12% | 0.12 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -59.1 | -50.6 | -179.9 | -172.6 | 67.7 | 0 | 0 | 0 | 111.3 | L59 F188 N189 G194 C195 F196 L219 | L59-L192 HydrophobicContact CD1-CD1 3.82Å; F188-L192 HydrophobicContact CE1-CB 4.29Å; F188-L192 HydrophobicContact CE1-CD1 4.42Å; F188-L192 HydrophobicContact CE1-CD2 4.37Å; F188-L192 HydrophobicContact CZ-CD1 4.4Å; F188-L192 PolarHBondContact O-N 3.44Å; N189-L192 PolarHBondContact O-N 3.1Å; L192-G194 PolarHBondContact O-N 3.06Å; L192-C195 PolarHBondContact O-N 3.36Å; L192-F196 HydrophobicContact CD1-CD2 4.1Å; L192-F196 HydrophobicContact CD1-CE2 3.54Å; L192-F196 HydrophobicContact CD1-CZ 4.47Å; L192-F196 HydrophobicContact CG-CD2 4.02Å; L192-F196 HydrophobicContact CG-CE2 3.8Å; L192-F196 VanDerWaalsContact O-CD2 3.23Å; L192-F196 WeakPolarHBondContact O-CD2 3.22Å; L192-F196 PolarHBondContact O-N 3.24Å; L192-F196 VanDerWaalsContact O-N 3.11Å; L192-L219 HydrophobicContact CD1-CD1 3.96Å; L192-L219 HydrophobicContact CD1-CD2 4.27Å |
| 193 | A | 84 | Confident | 87.1 | Confident | 34 Ų | 34 | 24.8 Ų | 24.8 | 28% | 0.281 | 14% | 0.142 | S | C | . | . | H | α-helix | trans | -60.5 | -44.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | N189 C195 F196 S197 | N189-A193 WeakPolarHBondContact O-CB 3.06Å; N189-A193 PolarHBondContact O-N 3.1Å; A193-C195 PolarHBondContact O-N 3.31Å; A193-F196 PolarHBondContact O-N 2.84Å; A193-S197 WeakPolarHBondContact O-CB 3.44Å; A193-S197 PolarHBondContact O-N 2.91Å; A193-S197 PolarHBondContact O-OG 2.94Å; A193-S197 VanDerWaalsContact O-OG 3.08Å |
| 194 | G | 86.9 | Confident | 86.4 | Confident | 2 Ų | 2 | 31 Ų | 31 | 2% | 0.021 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -60.1 | -42.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.9 | A190 V191 L192 Y198 | A190-G194 PolarHBondContact O-N 2.85Å; V191-G194 PolarHBondContact O-N 2.71Å; L192-G194 PolarHBondContact O-N 3.06Å; G194-Y198 WeakPolarHBondContact O-CB 3.41Å; G194-Y198 PolarHBondContact O-N 3.17Å |
| 195 | C | 89.4 | Confident | 85.3 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -64.2 | -45.3 | 177.9 | -73.4 | 0 | 0 | 0 | 0 | 112 | V55 L59 V191 L192 A193 Y198 V199 L215 | V55-C195 HydrophobicContact CB-CB 4.38Å; V55-C195 HydrophobicContact CG2-CB 4.24Å; L59-C195 HydrophobicContact CD1-CB 4.4Å; V191-C195 WeakPolarHBondContact O-CB 3.46Å; V191-C195 PolarHBondContact O-N 3.11Å; V191-C195 PolarHBondContact O-SG 3.14Å; L192-C195 PolarHBondContact O-N 3.36Å; A193-C195 PolarHBondContact O-N 3.31Å; C195-Y198 PolarHBondContact O-N 2.89Å; C195-V199 WeakPolarHBondContact O-CG2 3.42Å; C195-V199 PolarHBondContact O-N 3.03Å; C195-L215 HydrophobicContact CB-CD1 4.39Å |
| 196 | F | 83.7 | Confident | 84.2 | Confident | 53 Ų | 53 | 46 Ų | 46 | 23% | 0.232 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -65.8 | -42.7 | 177.6 | -79.5 | -62.2 | 0 | 0 | 0 | 112.4 | L192 A193 V199 A200 V212 L215 | L192-F196 HydrophobicContact CD1-CD2 4.1Å; L192-F196 HydrophobicContact CD1-CE2 3.54Å; L192-F196 HydrophobicContact CD1-CZ 4.47Å; L192-F196 HydrophobicContact CG-CD2 4.02Å; L192-F196 HydrophobicContact CG-CE2 3.8Å; L192-F196 VanDerWaalsContact O-CD2 3.23Å; L192-F196 WeakPolarHBondContact O-CD2 3.22Å; L192-F196 PolarHBondContact O-N 3.24Å; L192-F196 VanDerWaalsContact O-N 3.11Å; A193-F196 PolarHBondContact O-N 2.84Å; F196-V199 PolarHBondContact O-N 3.46Å; F196-A200 WeakPolarHBondContact O-CB 3.43Å; F196-A200 PolarHBondContact O-N 3.14Å; F196-V212 HydrophobicContact CD1-CG2 4.21Å; F196-V212 HydrophobicContact CE1-CB 4.49Å; F196-V212 HydrophobicContact CE1-CG1 4Å; F196-V212 HydrophobicContact CE1-CG2 4.34Å; F196-L215 HydrophobicContact CD1-CD1 3.78Å; F196-L215 HydrophobicContact CE1-CB 4.24Å; F196-L215 HydrophobicContact CE1-CD1 3.87Å; F196-L215 HydrophobicContact CG-CD1 4.39Å |
| 197 | S | 82 | Confident | 83.8 | Confident | 42 Ų | 42 | 48 Ų | 48 | 29% | 0.294 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -64.2 | -44.2 | 176.4 | -64.4 | 0 | 0 | 0 | 0 | 111.7 | A193 V199 A200 D201 | A193-S197 WeakPolarHBondContact O-CB 3.44Å; A193-S197 PolarHBondContact O-N 2.91Å; A193-S197 PolarHBondContact O-OG 2.94Å; A193-S197 VanDerWaalsContact O-OG 3.08Å; S197-V199 PolarHBondContact O-N 3.5Å; S197-A200 WeakPolarHBondContact O-CB 3.49Å; S197-A200 PolarHBondContact O-N 3.43Å; S197-A200 VanDerWaalsContact O-N 3.12Å; S197-D201 VanDerWaalsContact O-CG 3.25Å; S197-D201 PolarHBondContact O-N 3.32Å |
| 198 | Y | 85.9 | Confident | 83.1 | Confident | 16 Ų | 16 | 52.2 Ų | 52.2 | 6% | 0.063 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61.4 | -45.3 | 176.9 | -174.2 | -88.4 | 0 | 0 | 0 | 111.8 | V55 R144 G194 C195 A200 D201 I202 I261 R262 | V55-Y198 HydrophobicContact CB-CD1 4.32Å; V55-Y198 HydrophobicContact CG1-CD1 3.22Å; V55-Y198 HydrophobicContact CG1-CD2 4.41Å; V55-Y198 HydrophobicContact CG1-CE1 3.74Å; V55-Y198 HydrophobicContact CG1-CG 3.6Å; V55-Y198 HydrophobicContact CG2-CD1 4.15Å; R144-Y198 HydrophobicContact CB-CD2 3.96Å; R144-Y198 HydrophobicContact CG-CD2 4.29Å; G194-Y198 WeakPolarHBondContact O-CB 3.41Å; G194-Y198 PolarHBondContact O-N 3.17Å; C195-Y198 PolarHBondContact O-N 2.89Å; Y198-A200 VanDerWaalsContact C-N 3.27Å; Y198-A200 PolarHBondContact O-N 3.32Å; Y198-D201 WeakPolarHBondContact O-CB 3.35Å; Y198-D201 PolarHBondContact O-N 2.74Å; Y198-D201 VanDerWaalsContact O-N 3.13Å; Y198-I202 HydrophobicContact CD1-CD1 3.96Å; Y198-I202 HydrophobicContact CD1-CG1 4.03Å; Y198-I202 HydrophobicContact CE1-CD1 3.42Å; Y198-I202 VanDerWaalsContact CE1-CD1 3.42Å; Y198-I202 HydrophobicContact CE1-CG1 3.88Å; Y198-I202 HydrophobicContact CE1-CG2 4.12Å; Y198-I202 VanDerWaalsContact O-CG1 3.31Å; Y198-I202 WeakPolarHBondContact O-CG1 3.39Å; Y198-I202 PolarHBondContact O-N 3.31Å; Y198-I261 HydrophobicContact CD2-CG2 4.43Å; Y198-I261 HydrophobicContact CE2-CG2 3.79Å; Y198-R262 VanDerWaalsContact CE2-O 3.24Å; Y198-R262 WeakPolarHBondContact CE2-O 3.35Å; Y198-R262 PolarHBondContact OH-O 3.2Å |
| 199 | V | 84.9 | Confident | 82.5 | Confident | 0 Ų | 0 | 56.4 Ų | 56.4 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -61.3 | -37.1 | 174.8 | 167.5 | 0 | 0 | 0 | 0 | 111.4 | V55 C195 F196 S197 D201 S203 R211 L215 | V55-V199 HydrophobicContact CG2-CG2 3.6Å; C195-V199 WeakPolarHBondContact O-CG2 3.42Å; C195-V199 PolarHBondContact O-N 3.03Å; F196-V199 PolarHBondContact O-N 3.46Å; S197-V199 PolarHBondContact O-N 3.5Å; V199-D201 VanDerWaalsContact C-N 3.32Å; V199-D201 PolarHBondContact O-N 3.07Å; V199-S203 WeakPolarHBondContact O-CB 3.46Å; V199-S203 PolarHBondContact O-N 3.35Å; V199-S203 PolarHBondContact O-OG 3.39Å; V199-R211 HydrophobicContact CG1-CB 3.59Å; V199-L215 HydrophobicContact CB-CD1 4.28Å; V199-L215 HydrophobicContact CG2-CD1 3.75Å; V199-L215 HydrophobicContact CG2-CD2 4.46Å; V199-L215 HydrophobicContact CG2-CG 4.31Å |
| 200 | A | 78.4 | Confident | 82.3 | Confident | 35 Ų | 35 | 61.3 Ų | 61.3 | 29% | 0.289 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -64 | -37.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | F196 S197 Y198 R208 | F196-A200 WeakPolarHBondContact O-CB 3.43Å; F196-A200 PolarHBondContact O-N 3.14Å; S197-A200 WeakPolarHBondContact O-CB 3.49Å; S197-A200 PolarHBondContact O-N 3.43Å; S197-A200 VanDerWaalsContact O-N 3.12Å; Y198-A200 VanDerWaalsContact C-N 3.27Å; Y198-A200 PolarHBondContact O-N 3.32Å; A200-R208 PolarHBondContact O-NH2 3.47Å |
| 201 | D | 80.9 | Confident | 82.1 | Confident | 72 Ų | 72 | 62.2 Ų | 62.2 | 39% | 0.385 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -68.4 | -42.4 | 178.9 | -64.2 | -20.7 | 0 | 0 | 0 | 112 | R144 S197 Y198 V199 S264 | R144-D201 IonicContact CZ-OD2 3.16Å; R144-D201 IonicContact NE-OD2 3.13Å; R144-D201 PolarHBondContact NE-OD2 2.95Å; R144-D201 IonicContact NH2-OD1 3.95Å; R144-D201 IonicContact NH2-OD2 3.66Å; S197-D201 VanDerWaalsContact O-CG 3.25Å; S197-D201 PolarHBondContact O-N 3.32Å; Y198-D201 WeakPolarHBondContact O-CB 3.35Å; Y198-D201 PolarHBondContact O-N 2.74Å; Y198-D201 VanDerWaalsContact O-N 3.13Å; V199-D201 VanDerWaalsContact C-N 3.32Å; V199-D201 PolarHBondContact O-N 3.07Å; D201-S264 PolarHBondContact OD2-OG 3.31Å; D201-S264 VanDerWaalsContact OD2-OG 3.05Å |
| 202 | I | 83.1 | Confident | 81.6 | Confident | 72 Ų | 72 | 64.6 Ų | 64.6 | 37% | 0.369 | 32% | 0.323 | S | S | . | . | S | Bend | trans | -97.9 | 8.2 | -173.1 | 66.1 | 153.7 | 0 | 0 | 0 | 114.6 | Y198 | Y198-I202 HydrophobicContact CD1-CD1 3.96Å; Y198-I202 HydrophobicContact CD1-CG1 4.03Å; Y198-I202 HydrophobicContact CE1-CD1 3.42Å; Y198-I202 VanDerWaalsContact CE1-CD1 3.42Å; Y198-I202 HydrophobicContact CE1-CG1 3.88Å; Y198-I202 HydrophobicContact CE1-CG2 4.12Å; Y198-I202 VanDerWaalsContact O-CG1 3.31Å; Y198-I202 WeakPolarHBondContact O-CG1 3.39Å; Y198-I202 PolarHBondContact O-N 3.31Å |
| 203 | S | 80.7 | Confident | 81.5 | Confident | 8 Ų | 8 | 64.9 Ų | 64.9 | 6% | 0.056 | 33% | 0.328 | C | S | . | . | trans | -127 | 134.9 | -176.4 | -44.8 | 0 | 0 | 0 | 0 | 113.5 | V199 R208 R211 | V199-S203 WeakPolarHBondContact O-CB 3.46Å; V199-S203 PolarHBondContact O-N 3.35Å; V199-S203 PolarHBondContact O-OG 3.39Å; S203-R208 PolarHBondContact O-NH2 2.94Å; S203-R208 VanDerWaalsContact O-NH2 3.17Å; S203-R211 WeakPolarHBondContact OG-CD 3.46Å; S203-R211 PolarHBondContact OG-NH1 3.46Å | ||
| 204 | D | 79.3 | Confident | 81.8 | Confident | 130 Ų | 130 | 65.3 Ų | 65.3 | 70% | 0.695 | 33% | 0.327 | S | S | * | . | trans | -66 | 159.2 | 170.3 | -56.6 | -49.3 | 0 | 0 | 0 | 112.2 | R206 S207 R208 | D204-R206 PolarHBondContact O-N 3.4Å; D204-S207 PolarHBondContact N-OG 2.98Å; D204-S207 PolarHBondContact O-N 3.17Å; D204-S207 VanDerWaalsContact O-N 3.13Å; D204-S207 PolarHBondContact O-OG 2.9Å; D204-R208 VanDerWaalsContact O-CB 3.32Å; D204-R208 WeakPolarHBondContact O-CB 3.11Å; D204-R208 PolarHBondContact O-N 3.43Å | ||
| 205 | K | 70.3 | Confident | 81.9 | Confident | 189 Ų | 189 | 65.2 Ų | 65.2 | 82% | 0.822 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -50.3 | -38.6 | -178 | -69.3 | -178.1 | 179.4 | 177.9 | 0 | 113.5 | ||
| 206 | R | 72.1 | Confident | 81.8 | Confident | 238 Ų | 238 | 67.4 Ų | 67.4 | 90% | 0.898 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -79.3 | -36.8 | -177.6 | -167.2 | 177.6 | -177.3 | -179.3 | 1.3 | 113.2 | D204 | D204-R206 PolarHBondContact O-N 3.4Å |
| 207 | S | 78.3 | Confident | 82.2 | Confident | 44 Ų | 44 | 66.1 Ų | 66.1 | 31% | 0.308 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -84.2 | -23.6 | -179.2 | 56.9 | 0 | 0 | 0 | 0 | 112.7 | D204 T209 F210 R211 | D204-S207 PolarHBondContact N-OG 2.98Å; D204-S207 PolarHBondContact O-N 3.17Å; D204-S207 VanDerWaalsContact O-N 3.13Å; D204-S207 PolarHBondContact O-OG 2.9Å; S207-T209 PolarHBondContact O-N 2.76Å; S207-F210 PolarHBondContact O-N 3.37Å; S207-F210 VanDerWaalsContact O-N 3.17Å; S207-R211 WeakPolarHBondContact O-CG 3.4Å; S207-R211 PolarHBondContact O-N 3.42Å |
| 208 | R | 76.4 | Confident | 82.8 | Confident | 95 Ų | 95 | 65.1 Ų | 65.1 | 36% | 0.358 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -54.2 | -47.6 | 179.4 | -171.3 | 179 | -55.3 | -178.4 | -0.8 | 113.3 | A200 S203 D204 F210 R211 V212 | A200-R208 PolarHBondContact O-NH2 3.47Å; S203-R208 PolarHBondContact O-NH2 2.94Å; S203-R208 VanDerWaalsContact O-NH2 3.17Å; D204-R208 VanDerWaalsContact O-CB 3.32Å; D204-R208 WeakPolarHBondContact O-CB 3.11Å; D204-R208 PolarHBondContact O-N 3.43Å; R208-F210 VanDerWaalsContact C-N 3.31Å; R208-F210 PolarHBondContact O-N 3.44Å; R208-R211 PolarHBondContact O-N 3.28Å; R208-V212 HydrophobicContact CG-CG2 4.46Å; R208-V212 WeakPolarHBondContact O-CB 3.35Å; R208-V212 WeakPolarHBondContact O-CG2 3.48Å; R208-V212 PolarHBondContact O-N 2.96Å |
| 209 | T | 78.9 | Confident | 83.1 | Confident | 107 Ų | 107 | 64.8 Ų | 64.8 | 66% | 0.656 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -60.7 | -41.7 | 179.7 | -51.8 | 0 | 0 | 0 | 0 | 111.8 | S207 A213 | S207-T209 PolarHBondContact O-N 2.76Å; T209-A213 WeakPolarHBondContact O-CB 3.34Å; T209-A213 PolarHBondContact O-N 3.28Å |
| 210 | F | 83.1 | Confident | 83.5 | Confident | 125 Ų | 125 | 64.8 Ų | 64.8 | 55% | 0.548 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -65.1 | -42.9 | 177 | 175.6 | -100.9 | 0 | 0 | 0 | 111.4 | S207 R208 A213 V214 | S207-F210 PolarHBondContact O-N 3.37Å; S207-F210 VanDerWaalsContact O-N 3.17Å; R208-F210 VanDerWaalsContact C-N 3.31Å; R208-F210 PolarHBondContact O-N 3.44Å; F210-A213 WeakPolarHBondContact O-CB 3.42Å; F210-A213 PolarHBondContact O-N 2.87Å; F210-V214 HydrophobicContact CD1-CG2 4.27Å; F210-V214 HydrophobicContact CE1-CG2 3.83Å; F210-V214 HydrophobicContact CE2-CG2 4.47Å; F210-V214 HydrophobicContact CZ-CG2 3.95Å; F210-V214 WeakPolarHBondContact O-CG2 3.45Å; F210-V214 PolarHBondContact O-N 2.94Å |
| 211 | R | 83.9 | Confident | 84.3 | Confident | 22 Ų | 22 | 66.3 Ų | 66.3 | 8% | 0.083 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -70.6 | -37.3 | -178.9 | -66.9 | -169.9 | 66.9 | -167.2 | 4.6 | 113.4 | S54 E56 V199 S203 S207 R208 A213 V214 L215 | S54-R211 PolarHBondContact OG-NH2 3.46Å; E56-R211 IonicContact OE1-CZ 3.08Å; E56-R211 IonicContact OE1-NE 3.71Å; E56-R211 IonicContact OE1-NH2 2.68Å; E56-R211 PolarHBondContact OE1-NH2 3.42Å; V199-R211 HydrophobicContact CG1-CB 3.59Å; S203-R211 WeakPolarHBondContact OG-CD 3.46Å; S203-R211 PolarHBondContact OG-NH1 3.46Å; S207-R211 WeakPolarHBondContact O-CG 3.4Å; S207-R211 PolarHBondContact O-N 3.42Å; R208-R211 PolarHBondContact O-N 3.28Å; R211-A213 VanDerWaalsContact C-N 3.27Å; R211-A213 PolarHBondContact O-N 2.95Å; R211-V214 WeakPolarHBondContact O-CB 3.16Å; R211-V214 PolarHBondContact O-N 2.98Å; R211-V214 VanDerWaalsContact O-N 3.16Å; R211-L215 PolarHBondContact O-N 3.37Å |
| 212 | V | 83.3 | Confident | 85.1 | Confident | 50 Ų | 50 | 62.9 Ų | 62.9 | 30% | 0.303 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -57.7 | -43.2 | 168.1 | 163.2 | 0 | 0 | 0 | 0 | 110.5 | F196 R208 V214 L215 E216 | F196-V212 HydrophobicContact CD1-CG2 4.21Å; F196-V212 HydrophobicContact CE1-CB 4.49Å; F196-V212 HydrophobicContact CE1-CG1 4Å; F196-V212 HydrophobicContact CE1-CG2 4.34Å; R208-V212 HydrophobicContact CG-CG2 4.46Å; R208-V212 WeakPolarHBondContact O-CB 3.35Å; R208-V212 WeakPolarHBondContact O-CG2 3.48Å; R208-V212 PolarHBondContact O-N 2.96Å; V212-V214 VanDerWaalsContact C-N 3.32Å; V212-V214 PolarHBondContact O-N 2.89Å; V212-L215 WeakPolarHBondContact O-CB 3.28Å; V212-L215 PolarHBondContact O-N 3.37Å; V212-E216 WeakPolarHBondContact O-CG 3.45Å; V212-E216 PolarHBondContact O-N 3.5Å |
| 213 | A | 85.9 | Confident | 85.7 | Confident | 28 Ų | 28 | 59.4 Ų | 59.4 | 23% | 0.231 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -64.3 | -35.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | T209 F210 R211 E216 A217 L358 | T209-A213 WeakPolarHBondContact O-CB 3.34Å; T209-A213 PolarHBondContact O-N 3.28Å; F210-A213 WeakPolarHBondContact O-CB 3.42Å; F210-A213 PolarHBondContact O-N 2.87Å; R211-A213 VanDerWaalsContact C-N 3.27Å; R211-A213 PolarHBondContact O-N 2.95Å; A213-E216 PolarHBondContact O-N 3.25Å; A213-A217 WeakPolarHBondContact O-CB 3.38Å; A213-A217 PolarHBondContact O-N 2.97Å; A213-L358 HydrophobicContact CB-CD1 3.7Å; A213-L358 HydrophobicContact CB-CD2 4.29Å; A213-L358 HydrophobicContact CB-CG 4.46Å |
| 214 | V | 90 | Very high | 86.4 | Confident | 43 Ų | 43 | 61.3 Ų | 61.3 | 26% | 0.261 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -64.4 | -42.7 | 172.9 | 173.5 | 0 | 0 | 0 | 0 | 111 | E56 F210 R211 V212 E216 A217 C218 | E56-V214 HydrophobicContact CG-CG1 3.87Å; F210-V214 HydrophobicContact CD1-CG2 4.27Å; F210-V214 HydrophobicContact CE1-CG2 3.83Å; F210-V214 HydrophobicContact CE2-CG2 4.47Å; F210-V214 HydrophobicContact CZ-CG2 3.95Å; F210-V214 WeakPolarHBondContact O-CG2 3.45Å; F210-V214 PolarHBondContact O-N 2.94Å; R211-V214 WeakPolarHBondContact O-CB 3.16Å; R211-V214 PolarHBondContact O-N 2.98Å; R211-V214 VanDerWaalsContact O-N 3.16Å; V212-V214 VanDerWaalsContact C-N 3.32Å; V212-V214 PolarHBondContact O-N 2.89Å; V214-E216 PolarHBondContact O-N 3.17Å; V214-A217 WeakPolarHBondContact O-CB 3.24Å; V214-A217 PolarHBondContact O-N 2.98Å; V214-C218 PolarHBondContact O-N 2.76Å; V214-C218 PolarHBondContact O-SG 3.17Å; V214-C218 VanDerWaalsContact O-SG 3.33Å |
| 215 | L | 89.5 | Confident | 87.3 | Confident | 0 Ų | 0 | 58.4 Ų | 58.4 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -60 | -45.6 | 175.9 | -66.6 | -176.9 | 0 | 0 | 0 | 112.1 | V55 E56 L59 C195 F196 V199 R211 V212 A217 C218 L219 | V55-L215 HydrophobicContact CG2-CD2 4.07Å; E56-L215 HydrophobicContact CG-CD2 3.97Å; L59-L215 HydrophobicContact CD2-CB 3.66Å; L59-L215 HydrophobicContact CD2-CD2 3.73Å; L59-L215 HydrophobicContact CD2-CG 4.14Å; C195-L215 HydrophobicContact CB-CD1 4.39Å; F196-L215 HydrophobicContact CD1-CD1 3.78Å; F196-L215 HydrophobicContact CE1-CB 4.24Å; F196-L215 HydrophobicContact CE1-CD1 3.87Å; F196-L215 HydrophobicContact CG-CD1 4.39Å; V199-L215 HydrophobicContact CB-CD1 4.28Å; V199-L215 HydrophobicContact CG2-CD1 3.75Å; V199-L215 HydrophobicContact CG2-CD2 4.46Å; V199-L215 HydrophobicContact CG2-CG 4.31Å; R211-L215 PolarHBondContact O-N 3.37Å; V212-L215 WeakPolarHBondContact O-CB 3.28Å; V212-L215 PolarHBondContact O-N 3.37Å; L215-A217 VanDerWaalsContact C-N 3.32Å; L215-A217 PolarHBondContact O-N 3.34Å; L215-C218 WeakPolarHBondContact O-CB 3.24Å; L215-C218 PolarHBondContact O-N 3.04Å; L215-C218 VanDerWaalsContact O-N 3.14Å; L215-L219 PolarHBondContact O-N 3.48Å |
| 216 | E | 87.8 | Confident | 88.5 | Confident | 46 Ų | 46 | 49.4 Ų | 49.4 | 22% | 0.215 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -61.7 | -39.9 | 175.8 | -68.5 | -70.4 | 175.6 | 0 | 0 | 112 | V212 A213 V214 C218 L219 G220 L358 | V212-E216 WeakPolarHBondContact O-CG 3.45Å; V212-E216 PolarHBondContact O-N 3.5Å; A213-E216 PolarHBondContact O-N 3.25Å; V214-E216 PolarHBondContact O-N 3.17Å; E216-C218 VanDerWaalsContact C-N 3.33Å; E216-C218 PolarHBondContact O-N 3.47Å; E216-L219 WeakPolarHBondContact O-CB 3.22Å; E216-L219 PolarHBondContact O-N 2.95Å; E216-G220 PolarHBondContact O-N 2.98Å; E216-G220 VanDerWaalsContact O-N 3.11Å; E216-L358 HydrophobicContact CB-CD1 3.69Å; E216-L358 HydrophobicContact CG-CD1 4.34Å |
| 217 | A | 91.4 | Very high | 89.7 | Confident | 27 Ų | 27 | 38.2 Ų | 38.2 | 22% | 0.223 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63.2 | -39.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | A213 V214 L215 L219 G220 I221 | A213-A217 WeakPolarHBondContact O-CB 3.38Å; A213-A217 PolarHBondContact O-N 2.97Å; V214-A217 WeakPolarHBondContact O-CB 3.24Å; V214-A217 PolarHBondContact O-N 2.98Å; L215-A217 VanDerWaalsContact C-N 3.32Å; L215-A217 PolarHBondContact O-N 3.34Å; A217-L219 VanDerWaalsContact C-N 3.3Å; A217-L219 PolarHBondContact O-N 3.37Å; A217-G220 PolarHBondContact O-N 3.33Å; A217-I221 WeakPolarHBondContact O-CB 3.17Å; A217-I221 VanDerWaalsContact O-CG1 3.26Å; A217-I221 WeakPolarHBondContact O-CG1 3.21Å; A217-I221 PolarHBondContact O-N 2.95Å |
| 218 | C | 94.1 | Very high | 90.5 | Very high | 20 Ų | 20 | 39.1 Ų | 39.1 | 14% | 0.135 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -59.5 | -41 | 173.1 | -69.4 | 0 | 0 | 0 | 0 | 111.5 | F60 V214 L215 E216 S222 | F60-C218 HydrophobicContact CB-CB 4.39Å; F60-C218 HydrophobicContact CD2-CB 4.3Å; V214-C218 PolarHBondContact O-N 2.76Å; V214-C218 PolarHBondContact O-SG 3.17Å; V214-C218 VanDerWaalsContact O-SG 3.33Å; L215-C218 WeakPolarHBondContact O-CB 3.24Å; L215-C218 PolarHBondContact O-N 3.04Å; L215-C218 VanDerWaalsContact O-N 3.14Å; E216-C218 VanDerWaalsContact C-N 3.33Å; E216-C218 PolarHBondContact O-N 3.47Å; C218-S222 WeakPolarHBondContact O-CB 3.19Å; C218-S222 PolarHBondContact O-N 3.14Å; C218-S222 PolarHBondContact O-OG 3.37Å |
| 219 | L | 92.6 | Very high | 91.4 | Very high | 10 Ų | 10 | 37.7 Ų | 37.7 | 5% | 0.052 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.3 | -48.4 | 177.5 | -65.9 | 176.1 | 0 | 0 | 0 | 112.1 | L59 M63 F188 L192 L215 E216 A217 S222 G223 | L59-L219 HydrophobicContact CD1-CD2 3.82Å; L59-L219 HydrophobicContact CD2-CD2 4.02Å; L59-L219 HydrophobicContact CD2-CG 4.11Å; L59-L219 HydrophobicContact CG-CD2 3.8Å; L59-L219 HydrophobicContact CG-CG 4.41Å; M63-L219 HydrophobicContact CB-CD2 3.82Å; M63-L219 HydrophobicContact CG-CB 4.45Å; M63-L219 HydrophobicContact CG-CD2 3.76Å; M63-L219 HydrophobicContact SD-CD2 4.19Å; F188-L219 HydrophobicContact CZ-CD2 3.77Å; L192-L219 HydrophobicContact CD1-CD1 3.96Å; L192-L219 HydrophobicContact CD1-CD2 4.27Å; L215-L219 PolarHBondContact O-N 3.48Å; E216-L219 WeakPolarHBondContact O-CB 3.22Å; E216-L219 PolarHBondContact O-N 2.95Å; A217-L219 VanDerWaalsContact C-N 3.3Å; A217-L219 PolarHBondContact O-N 3.37Å; L219-S222 PolarHBondContact O-OG 3.45Å; L219-S222 VanDerWaalsContact O-OG 3.13Å; L219-G223 PolarHBondContact O-N 2.92Å; L219-G223 VanDerWaalsContact O-N 3.08Å |
| 220 | G | 93.3 | Very high | 92.2 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -65.6 | -47.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | E216 A217 G223 M224 N351 | E216-G220 PolarHBondContact O-N 2.98Å; E216-G220 VanDerWaalsContact O-N 3.11Å; A217-G220 PolarHBondContact O-N 3.33Å; G220-G223 PolarHBondContact O-N 2.96Å; G220-M224 VanDerWaalsContact O-CB 3.3Å; G220-M224 WeakPolarHBondContact O-CB 3.35Å; G220-M224 PolarHBondContact O-N 3.43Å; G220-N351 WeakPolarHBondContact CA-O 3.32Å |
| 221 | I | 96.1 | Very high | 92.6 | Very high | 66 Ų | 66 | 26.9 Ų | 26.9 | 34% | 0.338 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -68 | -46.8 | -176.3 | -63.5 | 170.5 | 0 | 0 | 0 | 110.5 | F60 A217 G223 M224 L225 L355 | F60-I221 HydrophobicContact CE2-CB 4.4Å; F60-I221 HydrophobicContact CE2-CG2 4.07Å; A217-I221 WeakPolarHBondContact O-CB 3.17Å; A217-I221 VanDerWaalsContact O-CG1 3.26Å; A217-I221 WeakPolarHBondContact O-CG1 3.21Å; A217-I221 PolarHBondContact O-N 2.95Å; I221-G223 VanDerWaalsContact C-N 3.34Å; I221-G223 PolarHBondContact O-N 3.47Å; I221-M224 PolarHBondContact O-N 3.02Å; I221-L225 HydrophobicContact CG2-CD1 3.88Å; I221-L225 HydrophobicContact CG2-CG 4.36Å; I221-L225 WeakPolarHBondContact O-CG 3.27Å; I221-L225 PolarHBondContact O-N 3.2Å; I221-L355 HydrophobicContact CD1-CD2 4.05Å; I221-L355 HydrophobicContact CG1-CD1 3.92Å; I221-L355 HydrophobicContact CG1-CD2 3.73Å; I221-L355 HydrophobicContact CG1-CG 4.34Å |
| 222 | S | 96.6 | Very high | 93.1 | Very high | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -60.6 | -45.1 | 178.1 | 58.4 | 0 | 0 | 0 | 0 | 111.2 | F60 M63 C218 L219 M224 L225 A226 | F60-S222 VanDerWaalsContact O-CB 3.31Å; F60-S222 WeakPolarHBondContact O-CB 3.26Å; M63-S222 WeakPolarHBondContact CB-OG 3.17Å; M63-S222 WeakPolarHBondContact CG-OG 3.39Å; C218-S222 WeakPolarHBondContact O-CB 3.19Å; C218-S222 PolarHBondContact O-N 3.14Å; C218-S222 PolarHBondContact O-OG 3.37Å; L219-S222 PolarHBondContact O-OG 3.45Å; L219-S222 VanDerWaalsContact O-OG 3.13Å; S222-M224 PolarHBondContact O-N 2.95Å; S222-L225 PolarHBondContact O-N 3Å; S222-A226 WeakPolarHBondContact O-CB 3.46Å; S222-A226 PolarHBondContact O-N 3.2Å |
| 223 | G | 95.8 | Very high | 93.6 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -63.3 | -41 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | L219 G220 I221 S227 N351 | L219-G223 PolarHBondContact O-N 2.92Å; L219-G223 VanDerWaalsContact O-N 3.08Å; G220-G223 PolarHBondContact O-N 2.96Å; I221-G223 VanDerWaalsContact C-N 3.34Å; I221-G223 PolarHBondContact O-N 3.47Å; G223-S227 WeakPolarHBondContact O-CB 3.39Å; G223-S227 PolarHBondContact O-N 2.96Å; G223-S227 PolarHBondContact O-OG 3.17Å; G223-N351 PolarHBondContact O-ND2 2.91Å |
| 224 | M | 96.1 | Very high | 93.9 | Very high | 47 Ų | 47 | 31.2 Ų | 31.2 | 23% | 0.232 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62.9 | -50.7 | 176.2 | -177.1 | -174.3 | 66.4 | 0 | 0 | 111.5 | G220 I221 S222 S227 I228 A348 N351 L352 | G220-M224 VanDerWaalsContact O-CB 3.3Å; G220-M224 WeakPolarHBondContact O-CB 3.35Å; G220-M224 PolarHBondContact O-N 3.43Å; I221-M224 PolarHBondContact O-N 3.02Å; S222-M224 PolarHBondContact O-N 2.95Å; M224-S227 PolarHBondContact O-N 3.17Å; M224-I228 HydrophobicContact CG-CD1 4.25Å; M224-I228 WeakPolarHBondContact O-CG1 3.13Å; M224-I228 PolarHBondContact O-N 3.06Å; M224-I228 VanDerWaalsContact O-N 3.15Å; M224-A348 HydrophobicContact CG-CB 4.01Å; M224-N351 HydrophobicContact CB-CB 4.37Å; M224-L352 HydrophobicContact SD-CB 4.3Å; M224-L352 HydrophobicContact SD-CD1 3.91Å |
| 225 | L | 97.3 | Very high | 93.8 | Very high | 69 Ų | 69 | 36.4 Ų | 36.4 | 36% | 0.361 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -62.2 | -46 | 179.2 | -69.6 | 173.9 | 0 | 0 | 0 | 111.5 | F60 F64 I221 S222 S227 I228 I229 | F60-L225 HydrophobicContact CZ-CD1 4.15Å; F64-L225 HydrophobicContact CD2-CB 4.49Å; F64-L225 HydrophobicContact CE2-CB 4.13Å; I221-L225 HydrophobicContact CG2-CD1 3.88Å; I221-L225 HydrophobicContact CG2-CG 4.36Å; I221-L225 WeakPolarHBondContact O-CG 3.27Å; I221-L225 PolarHBondContact O-N 3.2Å; S222-L225 PolarHBondContact O-N 3Å; L225-S227 VanDerWaalsContact C-N 3.3Å; L225-S227 PolarHBondContact O-N 3.16Å; L225-I228 PolarHBondContact O-N 3.45Å; L225-I229 VanDerWaalsContact O-CB 3.3Å; L225-I229 WeakPolarHBondContact O-CB 3.16Å; L225-I229 WeakPolarHBondContact O-CD1 3.5Å; L225-I229 WeakPolarHBondContact O-CG1 3.28Å; L225-I229 PolarHBondContact O-N 2.99Å |
| 226 | A | 97.1 | Very high | 93.8 | Very high | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -58.6 | -41.1 | 178 | 0 | 0 | 0 | 0 | 0 | 112.4 | F64 A67 L68 S222 G230 | F64-A226 HydrophobicContact CD1-CB 4.39Å; F64-A226 HydrophobicContact CD2-CB 3.69Å; F64-A226 HydrophobicContact CE2-CB 3.83Å; F64-A226 HydrophobicContact CG-CB 3.99Å; F64-A226 HydrophobicContact CZ-CB 4.24Å; F64-A226 VanDerWaalsContact O-CB 3.26Å; F64-A226 WeakPolarHBondContact O-CB 3.43Å; A67-A226 HydrophobicContact CB-CB 3.79Å; L68-A226 HydrophobicContact CB-CB 4.07Å; S222-A226 WeakPolarHBondContact O-CB 3.46Å; S222-A226 PolarHBondContact O-N 3.2Å; A226-G230 WeakPolarHBondContact O-CA 3.32Å; A226-G230 PolarHBondContact O-N 3Å |
| 227 | S | 95.9 | Very high | 93.9 | Very high | 4 Ų | 4 | 43.5 Ų | 43.5 | 3% | 0.028 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -67.7 | -45 | -179.6 | -59.3 | 0 | 0 | 0 | 0 | 112.3 | G223 M224 L225 G231 G344 S347 N351 | G223-S227 WeakPolarHBondContact O-CB 3.39Å; G223-S227 PolarHBondContact O-N 2.96Å; G223-S227 PolarHBondContact O-OG 3.17Å; M224-S227 PolarHBondContact O-N 3.17Å; L225-S227 VanDerWaalsContact C-N 3.3Å; L225-S227 PolarHBondContact O-N 3.16Å; S227-G231 PolarHBondContact O-N 3.05Å; S227-G344 WeakPolarHBondContact CB-O 3.26Å; S227-G344 VanDerWaalsContact O-CA 3.26Å; S227-G344 WeakPolarHBondContact O-CA 3.14Å; S227-S347 WeakPolarHBondContact OG-CB 3.44Å; S227-N351 PolarHBondContact OG-ND2 3.37Å |
| 228 | I | 95.8 | Very high | 93.9 | Very high | 62 Ų | 62 | 43.5 Ų | 43.5 | 32% | 0.318 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -64.1 | -49.9 | 177.5 | -64.3 | 171.7 | 0 | 0 | 0 | 110.2 | M224 L225 Q232 Y345 A348 | M224-I228 HydrophobicContact CG-CD1 4.25Å; M224-I228 WeakPolarHBondContact O-CG1 3.13Å; M224-I228 PolarHBondContact O-N 3.06Å; M224-I228 VanDerWaalsContact O-N 3.15Å; L225-I228 PolarHBondContact O-N 3.45Å; I228-Q232 WeakPolarHBondContact O-CG 3.2Å; I228-Q232 PolarHBondContact O-N 2.99Å; I228-Y345 HydrophobicContact CG1-CD1 4.48Å; I228-Y345 HydrophobicContact CG2-CE1 4.48Å; I228-A348 HydrophobicContact CD1-CB 4.13Å; I228-A348 HydrophobicContact CG1-CB 3.63Å |
| 229 | I | 95.8 | Very high | 93.7 | Very high | 66 Ų | 66 | 44 Ų | 44 | 34% | 0.338 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -60.7 | -49 | 179.7 | -69.5 | 168.3 | 0 | 0 | 0 | 109.6 | F64 L225 G231 Q232 W233 | F64-I229 HydrophobicContact CE2-CD1 4.04Å; F64-I229 HydrophobicContact CZ-CD1 3.98Å; L225-I229 VanDerWaalsContact O-CB 3.3Å; L225-I229 WeakPolarHBondContact O-CB 3.16Å; L225-I229 WeakPolarHBondContact O-CD1 3.5Å; L225-I229 WeakPolarHBondContact O-CG1 3.28Å; L225-I229 PolarHBondContact O-N 2.99Å; I229-G231 PolarHBondContact O-N 3.02Å; I229-Q232 PolarHBondContact O-N 3.2Å; I229-W233 HydrophobicContact CG2-CE3 3.63Å; I229-W233 HydrophobicContact CG2-CZ3 4.12Å; I229-W233 WeakPolarHBondContact O-CB 3.21Å; I229-W233 PolarHBondContact O-N 3.06Å |
| 230 | G | 94.6 | Very high | 93.7 | Very high | 2 Ų | 2 | 45.9 Ų | 45.9 | 2% | 0.021 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -60.4 | -45.4 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | A226 W233 R234 | A226-G230 WeakPolarHBondContact O-CA 3.32Å; A226-G230 PolarHBondContact O-N 3Å; G230-W233 PolarHBondContact O-N 3.06Å; G230-R234 WeakPolarHBondContact O-CB 3.37Å; G230-R234 PolarHBondContact O-N 2.92Å |
| 231 | G | 93 | Very high | 93.8 | Very high | 3 Ų | 3 | 49 Ų | 49 | 3% | 0.031 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.8 | -44.8 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | S227 I229 R235 S340 | S227-G231 PolarHBondContact O-N 3.05Å; I229-G231 PolarHBondContact O-N 3.02Å; G231-R235 PolarHBondContact O-N 2.88Å; G231-S340 CarbonylContact C-O 3.58Å; G231-S340 WeakPolarHBondContact CA-O 3.43Å; G231-S340 CarbonylContact O-C 3.57Å; G231-S340 VanDerWaalsContact O-CB 3.3Å; G231-S340 WeakPolarHBondContact O-CB 3.41Å; G231-S340 PolarHBondContact O-OG 3.31Å |
| 232 | Q | 93.5 | Very high | 93.7 | Very high | 71 Ų | 71 | 45.8 Ų | 45.8 | 33% | 0.332 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -70.7 | -40 | 177.3 | -65.6 | -60.9 | -19.5 | 0 | 0 | 112 | I228 I229 R235 A236 Y345 | I228-Q232 WeakPolarHBondContact O-CG 3.2Å; I228-Q232 PolarHBondContact O-N 2.99Å; I229-Q232 PolarHBondContact O-N 3.2Å; Q232-R235 VanDerWaalsContact O-CB 3.32Å; Q232-R235 WeakPolarHBondContact O-CB 3.5Å; Q232-R235 PolarHBondContact O-N 3.34Å; Q232-A236 PolarHBondContact O-N 2.57Å; Q232-A236 VanDerWaalsContact O-N 3.12Å; Q232-Y345 PolarHBondContact NE2-OH 3.09Å |
| 233 | W | 94.1 | Very high | 93.7 | Very high | 81 Ų | 81 | 45.8 Ų | 45.8 | 31% | 0.307 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -68.5 | -40.9 | -179.3 | -159.1 | -17.8 | 0 | 0 | 0 | 111.6 | I229 G230 R235 A236 Q237 N241 P242 L245 | I229-W233 HydrophobicContact CG2-CE3 3.63Å; I229-W233 HydrophobicContact CG2-CZ3 4.12Å; I229-W233 WeakPolarHBondContact O-CB 3.21Å; I229-W233 PolarHBondContact O-N 3.06Å; G230-W233 PolarHBondContact O-N 3.06Å; W233-R235 VanDerWaalsContact C-N 3.25Å; W233-R235 PolarHBondContact O-N 2.88Å; W233-A236 PolarHBondContact O-N 3.39Å; W233-A236 VanDerWaalsContact O-N 3.14Å; W233-Q237 PolarHBondContact O-N 3.42Å; W233-N241 HydrophobicContact CZ2-CB 4.34Å; W233-P242 HydrophobicContact CB-CG 4.09Å; W233-P242 HydrophobicContact CD2-CG 4.25Å; W233-P242 HydrophobicContact CG-CG 3.86Å; W233-L245 HydrophobicContact CE3-CD2 4.36Å; W233-L245 HydrophobicContact CH2-CD2 4.23Å; W233-L245 HydrophobicContact CZ3-CD2 3.57Å |
| 234 | R | 91.9 | Very high | 93.8 | Very high | 39 Ų | 39 | 51.7 Ų | 51.7 | 15% | 0.147 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -53.8 | -45.5 | 170.4 | 175.7 | -176 | 171.7 | -122.6 | -1.8 | 110.9 | L72 Q75 D79 G230 A236 G238 Y239 S340 | L72-R234 HydrophobicContact CD2-CB 3.71Å; L72-R234 HydrophobicContact CD2-CG 4.21Å; Q75-R234 VanDerWaalsContact OE1-CZ 3.29Å; D79-R234 IonicContact OD1-NH2 2.96Å; D79-R234 IonicContact OD2-CZ 2.62Å; D79-R234 IonicContact OD2-NH2 3.8Å; D79-R234 PolarHBondContact OD2-NH2 3.42Å; G230-R234 WeakPolarHBondContact O-CB 3.37Å; G230-R234 PolarHBondContact O-N 2.92Å; R234-A236 VanDerWaalsContact C-N 3.29Å; R234-A236 PolarHBondContact O-N 3.48Å; R234-G238 VanDerWaalsContact O-CA 3.3Å; R234-G238 WeakPolarHBondContact O-CA 3.37Å; R234-G238 PolarHBondContact O-N 2.87Å; R234-Y239 HydrophobicContact CG-CD1 4.34Å; R234-Y239 HydrophobicContact CG-CE1 4.05Å; R234-Y239 VanDerWaalsContact NE-CE1 3.28Å; R234-Y239 PolarHBondContact NE-OH 3.33Å; R234-Y239 PolarHBondContact NH2-OH 2.77Å; R234-S340 VanDerWaalsContact CD-CB 3.46Å; R234-S340 VanDerWaalsContact NH1-CB 3.33Å |
| 235 | R | 87.9 | Confident | 93.8 | Very high | 151 Ų | 151 | 51.7 Ų | 51.7 | 57% | 0.57 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -59.7 | -40.7 | -179.8 | -163 | -171.7 | 178.6 | 98.6 | -0.7 | 112 | G231 Q232 W233 D339 S340 | G231-R235 PolarHBondContact O-N 2.88Å; Q232-R235 VanDerWaalsContact O-CB 3.32Å; Q232-R235 WeakPolarHBondContact O-CB 3.5Å; Q232-R235 PolarHBondContact O-N 3.34Å; W233-R235 VanDerWaalsContact C-N 3.25Å; W233-R235 PolarHBondContact O-N 2.88Å; R235-D339 IonicContact CZ-OD2 2.82Å; R235-D339 VanDerWaalsContact NH1-CG 3.35Å; R235-D339 IonicContact NH1-OD1 3.95Å; R235-D339 IonicContact NH1-OD2 3.97Å; R235-D339 PolarHBondContact NH1-OD2 3.2Å; R235-S340 WeakPolarHBondContact CB-OG 3.37Å; R235-S340 PolarHBondContact N-OG 3.03Å |
| 236 | A | 90.3 | Very high | 93.8 | Very high | 82 Ų | 82 | 48.4 Ų | 48.4 | 68% | 0.678 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -85.1 | -39.3 | -172.6 | 0 | 0 | 0 | 0 | 0 | 114 | Q232 W233 R234 | Q232-A236 PolarHBondContact O-N 2.57Å; Q232-A236 VanDerWaalsContact O-N 3.12Å; W233-A236 PolarHBondContact O-N 3.39Å; W233-A236 VanDerWaalsContact O-N 3.14Å; R234-A236 VanDerWaalsContact C-N 3.29Å; R234-A236 PolarHBondContact O-N 3.48Å |
| 237 | Q | 89.7 | Confident | 93.9 | Very high | 114 Ų | 114 | 49.2 Ų | 49.2 | 53% | 0.533 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -133.9 | 7.4 | -169.1 | -58.2 | -173.7 | -17.5 | 0 | 0 | 114.2 | W233 N241 | W233-Q237 PolarHBondContact O-N 3.42Å; Q237-N241 PolarHBondContact OE1-ND2 3.36Å |
| 238 | G | 90.1 | Very high | 94 | Very high | 27 Ų | 27 | 51.5 Ų | 51.5 | 28% | 0.278 | 26% | 0.262 | S | S | . | . | trans | 74.3 | -161.2 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | R234 P242 | R234-G238 VanDerWaalsContact O-CA 3.3Å; R234-G238 WeakPolarHBondContact O-CA 3.37Å; R234-G238 PolarHBondContact O-N 2.87Å; G238-P242 WeakPolarHBondContact O-CD 3.44Å | ||
| 239 | Y | 89.5 | Confident | 94.1 | Very high | 31 Ų | 31 | 49.2 Ų | 49.2 | 12% | 0.122 | 25% | 0.251 | C | S | . | . | S | Bend | trans | -82.7 | -35.9 | -168.2 | -62.5 | -78.8 | 0 | 0 | 0 | 114.7 | Q75 Y76 D79 R234 N241 P242 F243 | Q75-Y239 VanDerWaalsContact C-OH 3.23Å; Q75-Y239 HydrophobicContact CB-CE1 3.94Å; Q75-Y239 PolarHBondContact O-OH 2.78Å; Q75-Y239 VanDerWaalsContact O-OH 3.1Å; Y76-Y239 HydrophobicContact CD2-CD1 4.38Å; Y76-Y239 AromaticContact CD2-CD2 3.72Å; Y76-Y239 HydrophobicContact CD2-CD2 3.72Å; Y76-Y239 HydrophobicContact CD2-CE2 4.01Å; Y76-Y239 AromaticContact CD2-CG 3.89Å; Y76-Y239 HydrophobicContact CD2-CG 3.89Å; Y76-Y239 HydrophobicContact CE2-CD2 4.45Å; Y76-Y239 PolarHBondContact N-OH 2.94Å; D79-Y239 PolarHBondContact OD2-OH 3.33Å; R234-Y239 HydrophobicContact CG-CD1 4.34Å; R234-Y239 HydrophobicContact CG-CE1 4.05Å; R234-Y239 VanDerWaalsContact NE-CE1 3.28Å; R234-Y239 PolarHBondContact NE-OH 3.33Å; R234-Y239 PolarHBondContact NH2-OH 2.77Å; Y239-N241 PolarHBondContact O-N 3.47Å; Y239-P242 VanDerWaalsContact O-CD 3.25Å; Y239-P242 WeakPolarHBondContact O-CD 3.46Å; Y239-F243 WeakPolarHBondContact O-CD2 3.5Å; Y239-F243 PolarHBondContact O-N 2.9Å |
| 240 | I | 93.8 | Very high | 94.2 | Very high | 49 Ų | 49 | 46 Ų | 46 | 25% | 0.251 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -64.2 | -45.5 | -163.7 | -64.2 | 175.6 | 0 | 0 | 0 | 112.2 | L163 M166 Y167 F243 W244 | L163-I240 HydrophobicContact CD2-CG2 4.08Å; M166-I240 HydrophobicContact CB-CG1 4.23Å; Y167-I240 HydrophobicContact CD1-CD1 4.05Å; Y167-I240 HydrophobicContact CE1-CD1 3.97Å; Y167-I240 HydrophobicContact CE1-CG2 3.93Å; Y167-I240 HydrophobicContact CE2-CG2 3.7Å; Y167-I240 WeakPolarHBondContact OH-CG2 3.33Å; I240-F243 PolarHBondContact O-N 3.01Å; I240-F243 VanDerWaalsContact O-N 3.15Å; I240-W244 PolarHBondContact O-N 3.43Å |
| 241 | N | 94.6 | Very high | 94.3 | Very high | 64 Ų | 64 | 49.8 Ų | 49.8 | 34% | 0.342 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -64.4 | -45 | -176.7 | -67.4 | -6.3 | 0 | 0 | 0 | 113 | W233 Q237 Y239 F243 W244 L245 | W233-N241 HydrophobicContact CZ2-CB 4.34Å; Q237-N241 PolarHBondContact OE1-ND2 3.36Å; Y239-N241 PolarHBondContact O-N 3.47Å; N241-F243 VanDerWaalsContact C-N 3.27Å; N241-F243 PolarHBondContact O-N 3.39Å; N241-W244 WeakPolarHBondContact O-CB 3.46Å; N241-W244 PolarHBondContact O-N 3.16Å; N241-W244 VanDerWaalsContact O-N 3.16Å; N241-L245 PolarHBondContact O-N 2.83Å |
| 242 | P | 95.6 | Very high | 94.6 | Very high | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -53.4 | -38.8 | 169.6 | -30.2 | 33.2 | 0 | 0 | 0 | 114.5 | L68 L72 W233 G238 Y239 W244 L245 V246 | L68-P242 HydrophobicContact CD1-CB 4.44Å; L72-P242 HydrophobicContact CD1-CB 3.41Å; L72-P242 VanDerWaalsContact CD1-CB 3.41Å; L72-P242 HydrophobicContact CD1-CG 4.12Å; W233-P242 HydrophobicContact CB-CG 4.09Å; W233-P242 HydrophobicContact CD2-CG 4.25Å; W233-P242 HydrophobicContact CG-CG 3.86Å; G238-P242 WeakPolarHBondContact O-CD 3.44Å; Y239-P242 VanDerWaalsContact O-CD 3.25Å; Y239-P242 WeakPolarHBondContact O-CD 3.46Å; P242-W244 VanDerWaalsContact C-N 3.35Å; P242-W244 PolarHBondContact O-N 3.4Å; P242-L245 WeakPolarHBondContact O-CB 3.34Å; P242-L245 PolarHBondContact O-N 3.37Å; P242-L245 VanDerWaalsContact O-N 3.1Å; P242-V246 WeakPolarHBondContact O-CG2 3.2Å; P242-V246 PolarHBondContact O-N 3.44Å |
| 243 | F | 96.2 | Very high | 94.7 | Very high | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -70.7 | -27.6 | 178.9 | -87 | -88 | 0 | 0 | 0 | 113.6 | Q69 L72 Y162 L163 M166 Y239 I240 N241 L245 V246 L247 | Q69-F243 HydrophobicContact CB-CE1 4.42Å; Q69-F243 HydrophobicContact CG-CE1 3.74Å; Q69-F243 HydrophobicContact CG-CZ 4.09Å; L72-F243 HydrophobicContact CB-CE2 3.86Å; L72-F243 HydrophobicContact CB-CZ 4.32Å; L72-F243 HydrophobicContact CD1-CE2 4.48Å; Y162-F243 HydrophobicContact CD2-CD1 4.34Å; Y162-F243 AromaticContact CD2-CE1 3.5Å; Y162-F243 HydrophobicContact CD2-CE1 3.5Å; Y162-F243 VanDerWaalsContact CD2-CE1 3.5Å; Y162-F243 HydrophobicContact CD2-CZ 4.09Å; Y162-F243 HydrophobicContact CE2-CE1 4.4Å; Y162-F243 HydrophobicContact CG-CE1 4.23Å; L163-F243 HydrophobicContact CD2-CB 3.6Å; L163-F243 HydrophobicContact CG-CB 3.98Å; M166-F243 HydrophobicContact CE-CD1 4.35Å; M166-F243 HydrophobicContact CE-CD2 3.56Å; M166-F243 HydrophobicContact CE-CE1 4.07Å; M166-F243 HydrophobicContact CE-CE2 3.22Å; M166-F243 HydrophobicContact CE-CG 4.12Å; M166-F243 HydrophobicContact CE-CZ 3.49Å; M166-F243 VanDerWaalsContact CE-CZ 3.49Å; M166-F243 HydrophobicContact SD-CD2 3.69Å; M166-F243 HydrophobicContact SD-CE2 3.99Å; M166-F243 HydrophobicContact SD-CG 4.15Å; Y239-F243 WeakPolarHBondContact O-CD2 3.5Å; Y239-F243 PolarHBondContact O-N 2.9Å; I240-F243 PolarHBondContact O-N 3.01Å; I240-F243 VanDerWaalsContact O-N 3.15Å; N241-F243 VanDerWaalsContact C-N 3.27Å; N241-F243 PolarHBondContact O-N 3.39Å; F243-L245 VanDerWaalsContact C-N 3.3Å; F243-V246 WeakPolarHBondContact O-CB 3.48Å; F243-V246 PolarHBondContact O-N 3.2Å; F243-L247 PolarHBondContact O-N 3.48Å |
| 244 | W | 97.1 | Very high | 94.8 | Very high | 124 Ų | 124 | 45 Ų | 45 | 47% | 0.47 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -64.6 | -36 | 167.4 | -81.3 | 107.3 | 0 | 0 | 0 | 112.1 | L163 Y167 I240 N241 P242 L247 A248 | L163-W244 HydrophobicContact CD1-CD2 3.83Å; L163-W244 HydrophobicContact CD1-CE3 4.1Å; L163-W244 HydrophobicContact CD1-CG 4.22Å; L163-W244 HydrophobicContact CD1-CH2 4.5Å; L163-W244 HydrophobicContact CD1-CZ2 4.26Å; L163-W244 HydrophobicContact CD1-CZ3 4.42Å; L163-W244 HydrophobicContact CD2-CD2 4.49Å; L163-W244 HydrophobicContact CD2-CG 4.24Å; Y167-W244 HydrophobicContact CE2-CZ2 4.4Å; Y167-W244 AromaticContact CE2-NE1 3.82Å; Y167-W244 AromaticContact CZ-NE1 3.89Å; Y167-W244 PolarHBondContact OH-NE1 3.41Å; I240-W244 PolarHBondContact O-N 3.43Å; N241-W244 WeakPolarHBondContact O-CB 3.46Å; N241-W244 PolarHBondContact O-N 3.16Å; N241-W244 VanDerWaalsContact O-N 3.16Å; P242-W244 VanDerWaalsContact C-N 3.35Å; P242-W244 PolarHBondContact O-N 3.4Å; W244-L247 HydrophobicContact CE3-CD2 3.81Å; W244-L247 HydrophobicContact CZ3-CD2 3.64Å; W244-L247 PolarHBondContact O-N 2.92Å; W244-A248 WeakPolarHBondContact O-CB 3.32Å; W244-A248 PolarHBondContact O-N 3Å |
| 245 | L | 96.8 | Very high | 95 | Very high | 46 Ų | 46 | 47.9 Ų | 47.9 | 24% | 0.241 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -68.6 | -37.4 | 174.4 | -177.3 | 62.2 | 0 | 0 | 0 | 112 | F64 L68 W233 N241 P242 F243 L247 A248 T249 | F64-L245 HydrophobicContact CE1-CD2 3.81Å; F64-L245 HydrophobicContact CE1-CG 4.23Å; F64-L245 HydrophobicContact CZ-CD2 4.24Å; L68-L245 HydrophobicContact CD2-CB 4.14Å; L68-L245 HydrophobicContact CD2-CD2 3.87Å; L68-L245 HydrophobicContact CD2-CG 4.08Å; W233-L245 HydrophobicContact CE3-CD2 4.36Å; W233-L245 HydrophobicContact CH2-CD2 4.23Å; W233-L245 HydrophobicContact CZ3-CD2 3.57Å; N241-L245 PolarHBondContact O-N 2.83Å; P242-L245 WeakPolarHBondContact O-CB 3.34Å; P242-L245 PolarHBondContact O-N 3.37Å; P242-L245 VanDerWaalsContact O-N 3.1Å; F243-L245 VanDerWaalsContact C-N 3.3Å; L245-L247 VanDerWaalsContact C-N 3.34Å; L245-A248 PolarHBondContact O-N 3.49Å; L245-T249 HydrophobicContact CD1-CG2 3.88Å; L245-T249 HydrophobicContact CG-CG2 4.2Å; L245-T249 WeakPolarHBondContact O-CB 3.37Å; L245-T249 VanDerWaalsContact O-CG2 3.32Å; L245-T249 WeakPolarHBondContact O-CG2 3.21Å; L245-T249 PolarHBondContact O-N 3.45Å; L245-T249 PolarHBondContact O-OG1 2.92Å |
| 246 | V | 97.4 | Very high | 95.4 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -56.9 | -48.2 | 170.8 | 170.3 | 0 | 0 | 0 | 0 | 110.1 | S65 L68 Q69 A159 P242 F243 T249 N250 | S65-V246 WeakPolarHBondContact OG-CG1 3.36Å; S65-V246 PolarHBondContact OG-O 2.87Å; L68-V246 HydrophobicContact CB-CG2 4.15Å; L68-V246 HydrophobicContact CD2-CG2 3.78Å; L68-V246 HydrophobicContact CG-CG2 3.9Å; Q69-V246 HydrophobicContact CB-CG1 4.24Å; Q69-V246 HydrophobicContact CB-CG2 4.04Å; A159-V246 HydrophobicContact CB-CG1 3.8Å; P242-V246 WeakPolarHBondContact O-CG2 3.2Å; P242-V246 PolarHBondContact O-N 3.44Å; F243-V246 WeakPolarHBondContact O-CB 3.48Å; F243-V246 PolarHBondContact O-N 3.2Å; V246-T249 PolarHBondContact O-OG1 3.48Å; V246-N250 PolarHBondContact O-N 3.47Å; V246-N250 PolarHBondContact O-ND2 2.9Å |
| 247 | L | 98.2 | Very high | 95.5 | Very high | 17 Ų | 17 | 39 Ų | 39 | 9% | 0.089 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60.7 | -50.1 | 176.4 | 175.9 | 57.8 | 0 | 0 | 0 | 111.8 | A156 A159 V160 L163 F243 W244 L245 T249 N250 L251 | A156-L247 HydrophobicContact CB-CD1 3.71Å; A156-L247 WeakPolarHBondContact O-CD1 3.45Å; A159-L247 HydrophobicContact CB-CB 4.03Å; V160-L247 HydrophobicContact CG2-CD1 3.83Å; V160-L247 HydrophobicContact CG2-CD2 3.9Å; L163-L247 HydrophobicContact CD1-CD2 4.18Å; F243-L247 PolarHBondContact O-N 3.48Å; W244-L247 HydrophobicContact CE3-CD2 3.81Å; W244-L247 HydrophobicContact CZ3-CD2 3.64Å; W244-L247 PolarHBondContact O-N 2.92Å; L245-L247 VanDerWaalsContact C-N 3.34Å; L247-T249 PolarHBondContact O-N 3.23Å; L247-N250 PolarHBondContact O-N 2.89Å; L247-L251 HydrophobicContact CD1-CD1 3.83Å; L247-L251 HydrophobicContact CD1-CG 4.07Å; L247-L251 HydrophobicContact CG-CD1 4.08Å; L247-L251 WeakPolarHBondContact O-CG 3.46Å; L247-L251 PolarHBondContact O-N 3.01Å |
| 248 | A | 97.9 | Very high | 95.6 | Very high | 52 Ų | 52 | 40.1 Ų | 40.1 | 43% | 0.43 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -62.1 | -41.8 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | W244 L245 L251 A252 | W244-A248 WeakPolarHBondContact O-CB 3.32Å; W244-A248 PolarHBondContact O-N 3Å; L245-A248 PolarHBondContact O-N 3.49Å; A248-L251 PolarHBondContact O-N 3.3Å; A248-A252 VanDerWaalsContact O-CB 3.23Å; A248-A252 WeakPolarHBondContact O-CB 3.31Å; A248-A252 PolarHBondContact O-N 2.85Å |
| 249 | T | 97.7 | Very high | 95.8 | Very high | 14 Ų | 14 | 43.7 Ų | 43.7 | 9% | 0.086 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -70 | -37.9 | -179.1 | 49.3 | 0 | 0 | 0 | 0 | 112.4 | L61 F64 L245 V246 L247 A252 S253 | L61-T249 HydrophobicContact CD2-CG2 4.37Å; F64-T249 HydrophobicContact CD1-CG2 4.07Å; F64-T249 HydrophobicContact CE1-CG2 4.4Å; L245-T249 HydrophobicContact CD1-CG2 3.88Å; L245-T249 HydrophobicContact CG-CG2 4.2Å; L245-T249 WeakPolarHBondContact O-CB 3.37Å; L245-T249 VanDerWaalsContact O-CG2 3.32Å; L245-T249 WeakPolarHBondContact O-CG2 3.21Å; L245-T249 PolarHBondContact O-N 3.45Å; L245-T249 PolarHBondContact O-OG1 2.92Å; V246-T249 PolarHBondContact O-OG1 3.48Å; L247-T249 PolarHBondContact O-N 3.23Å; T249-A252 PolarHBondContact O-N 2.93Å; T249-S253 WeakPolarHBondContact O-CB 3.28Å; T249-S253 PolarHBondContact O-N 3.39Å |
| 250 | N | 97.9 | Very high | 95.8 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -66.6 | -42.4 | 173.1 | -74.1 | -46.5 | 0 | 0 | 0 | 112.7 | S65 L155 A156 V246 L247 S253 A254 | S65-N250 WeakPolarHBondContact CB-OD1 3.41Å; S65-N250 PolarHBondContact OG-ND2 3.34Å; S65-N250 PolarHBondContact OG-OD1 2.99Å; L155-N250 HydrophobicContact CB-CB 4.44Å; A156-N250 HydrophobicContact CB-CB 3.95Å; V246-N250 PolarHBondContact O-N 3.47Å; V246-N250 PolarHBondContact O-ND2 2.9Å; L247-N250 PolarHBondContact O-N 2.89Å; N250-S253 WeakPolarHBondContact O-CB 3.32Å; N250-S253 PolarHBondContact O-N 2.9Å; N250-A254 PolarHBondContact O-N 3.47Å |
| 251 | L | 97.9 | Very high | 95.6 | Very high | 80 Ų | 80 | 46.4 Ų | 46.4 | 42% | 0.419 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -64.9 | -40.6 | 175.1 | -70 | 177 | 0 | 0 | 0 | 111.7 | A156 L247 A248 S253 A254 L255 | A156-L251 HydrophobicContact CB-CD2 3.77Å; A156-L251 HydrophobicContact CB-CG 3.99Å; L247-L251 HydrophobicContact CD1-CD1 3.83Å; L247-L251 HydrophobicContact CD1-CG 4.07Å; L247-L251 HydrophobicContact CG-CD1 4.08Å; L247-L251 WeakPolarHBondContact O-CG 3.46Å; L247-L251 PolarHBondContact O-N 3.01Å; A248-L251 PolarHBondContact O-N 3.3Å; L251-S253 VanDerWaalsContact C-N 3.32Å; L251-A254 PolarHBondContact O-N 3.01Å; L251-L255 VanDerWaalsContact O-CB 3.29Å; L251-L255 WeakPolarHBondContact O-CB 3.49Å; L251-L255 PolarHBondContact O-N 3.38Å |
| 252 | A | 97.8 | Very high | 95.1 | Very high | 44 Ų | 44 | 53.3 Ų | 53.3 | 36% | 0.364 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -63.8 | -38.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | L61 A248 T249 L255 Y256 | L61-A252 HydrophobicContact CD1-CB 4.27Å; A248-A252 VanDerWaalsContact O-CB 3.23Å; A248-A252 WeakPolarHBondContact O-CB 3.31Å; A248-A252 PolarHBondContact O-N 2.85Å; T249-A252 PolarHBondContact O-N 2.93Å; A252-L255 PolarHBondContact O-N 2.9Å; A252-Y256 VanDerWaalsContact O-CB 3.26Å; A252-Y256 WeakPolarHBondContact O-CB 3.48Å; A252-Y256 PolarHBondContact O-N 2.95Å |
| 253 | S | 96.7 | Very high | 94.5 | Very high | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -63.3 | -47.5 | 174.8 | -170.2 | 0 | 0 | 0 | 0 | 111.5 | V58 S62 N152 T249 N250 L251 L255 Y256 A257 | V58-S253 WeakPolarHBondContact CA-OG 3.21Å; V58-S253 WeakPolarHBondContact CG1-OG 3.22Å; V58-S253 PolarHBondContact O-OG 3.26Å; S62-S253 PolarHBondContact OG-OG 3.13Å; N152-S253 PolarHBondContact ND2-OG 2.62Å; N152-S253 WeakPolarHBondContact OD1-CB 3.47Å; N152-S253 PolarHBondContact OD1-OG 2.9Å; T249-S253 WeakPolarHBondContact O-CB 3.28Å; T249-S253 PolarHBondContact O-N 3.39Å; N250-S253 WeakPolarHBondContact O-CB 3.32Å; N250-S253 PolarHBondContact O-N 2.9Å; L251-S253 VanDerWaalsContact C-N 3.32Å; S253-L255 PolarHBondContact O-N 3.33Å; S253-Y256 PolarHBondContact O-N 3.22Å; S253-A257 WeakPolarHBondContact O-CB 3.2Å; S253-A257 PolarHBondContact O-N 3.14Å |
| 254 | A | 96.1 | Very high | 93.6 | Very high | 12 Ų | 12 | 58.4 Ų | 58.4 | 10% | 0.099 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -60.9 | -43.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | I149 N152 N250 L251 A257 Y258 | I149-A254 HydrophobicContact CG2-CB 4.32Å; N152-A254 HydrophobicContact CB-CB 3.89Å; N250-A254 PolarHBondContact O-N 3.47Å; L251-A254 PolarHBondContact O-N 3.01Å; A254-A257 PolarHBondContact O-N 3.13Å; A254-Y258 WeakPolarHBondContact O-CB 3.26Å; A254-Y258 PolarHBondContact O-N 2.73Å |
| 255 | L | 96.4 | Very high | 92.6 | Very high | 98 Ų | 98 | 54 Ų | 54 | 51% | 0.513 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -65.6 | -42.4 | 177.7 | -178.1 | 62.2 | 0 | 0 | 0 | 111.6 | L251 A252 S253 Y258 L259 | L251-L255 VanDerWaalsContact O-CB 3.29Å; L251-L255 WeakPolarHBondContact O-CB 3.49Å; L251-L255 PolarHBondContact O-N 3.38Å; A252-L255 PolarHBondContact O-N 2.9Å; S253-L255 PolarHBondContact O-N 3.33Å; L255-Y258 WeakPolarHBondContact O-CB 3.28Å; L255-Y258 PolarHBondContact O-N 3.41Å; L255-L259 HydrophobicContact CD1-CD1 3.81Å; L255-L259 HydrophobicContact CD1-CG 4.01Å; L255-L259 HydrophobicContact CD2-CD1 4.48Å; L255-L259 HydrophobicContact CG-CD1 3.86Å; L255-L259 HydrophobicContact CG-CG 4.36Å; L255-L259 WeakPolarHBondContact O-CG 3.14Å; L255-L259 PolarHBondContact O-N 3.19Å |
| 256 | Y | 95.3 | Very high | 91.3 | Very high | 47 Ų | 47 | 63 Ų | 63 | 18% | 0.184 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -62.2 | -45.5 | 176 | -177.8 | -83.3 | 0 | 0 | 0 | 110.9 | S54 P57 V58 A252 S253 Y258 L259 F260 | S54-Y256 WeakPolarHBondContact O-CE1 3.3Å; P57-Y256 HydrophobicContact CB-CD1 4.17Å; P57-Y256 HydrophobicContact CB-CD2 4.43Å; P57-Y256 HydrophobicContact CB-CE1 3.87Å; P57-Y256 HydrophobicContact CB-CE2 4.16Å; P57-Y256 HydrophobicContact CB-CG 4.45Å; P57-Y256 HydrophobicContact CG-CE1 3.89Å; P57-Y256 HydrophobicContact CG-CE2 4.17Å; V58-Y256 HydrophobicContact CG2-CD1 3.59Å; V58-Y256 HydrophobicContact CG2-CE1 4.23Å; A252-Y256 VanDerWaalsContact O-CB 3.26Å; A252-Y256 WeakPolarHBondContact O-CB 3.48Å; A252-Y256 PolarHBondContact O-N 2.95Å; S253-Y256 PolarHBondContact O-N 3.22Å; Y256-Y258 PolarHBondContact O-N 3.34Å; Y256-L259 PolarHBondContact O-N 3.44Å; Y256-F260 HydrophobicContact CD1-CB 4.43Å; Y256-F260 HydrophobicContact CD2-CB 4.43Å; Y256-F260 AromaticContact CD2-CD2 3.43Å; Y256-F260 HydrophobicContact CD2-CD2 3.43Å; Y256-F260 VanDerWaalsContact CD2-CD2 3.43Å; Y256-F260 AromaticContact CD2-CE2 4Å; Y256-F260 HydrophobicContact CD2-CE2 4Å; Y256-F260 HydrophobicContact CD2-CG 4.18Å; Y256-F260 HydrophobicContact CE1-CB 4.03Å; Y256-F260 HydrophobicContact CE2-CB 4.02Å; Y256-F260 AromaticContact CE2-CD2 3.55Å; Y256-F260 HydrophobicContact CE2-CD2 3.55Å; Y256-F260 HydrophobicContact CE2-CE2 4.22Å; Y256-F260 AromaticContact CE2-CG 3.87Å; Y256-F260 HydrophobicContact CE2-CG 3.87Å; Y256-F260 AromaticContact CG-CD2 4Å; Y256-F260 HydrophobicContact CG-CD2 4Å; Y256-F260 PolarHBondContact O-N 3.17Å |
| 257 | A | 93.2 | Very high | 90 | Very high | 0 Ų | 0 | 67 Ų | 67 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -59.7 | -37.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112 | V58 L148 I149 S253 A254 I261 | V58-A257 HydrophobicContact CG2-CB 3.91Å; L148-A257 HydrophobicContact CB-CB 4.31Å; I149-A257 HydrophobicContact CG1-CB 3.68Å; S253-A257 WeakPolarHBondContact O-CB 3.2Å; S253-A257 PolarHBondContact O-N 3.14Å; A254-A257 PolarHBondContact O-N 3.13Å; A257-I261 HydrophobicContact CB-CD1 3.9Å; A257-I261 WeakPolarHBondContact O-CB 3.39Å |
| 258 | Y | 92.4 | Very high | 88.7 | Confident | 137 Ų | 137 | 69.7 Ų | 69.7 | 54% | 0.537 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -69.5 | -42.9 | 174.8 | -178.6 | -92.1 | 0 | 0 | 0 | 112.8 | R145 I149 A254 L255 Y256 | R145-Y258 PolarHBondContact NH1-O 2.94Å; R145-Y258 VanDerWaalsContact NH1-O 3.07Å; R145-Y258 PolarHBondContact NH2-O 3.03Å; I149-Y258 HydrophobicContact CD1-CD2 4.18Å; A254-Y258 WeakPolarHBondContact O-CB 3.26Å; A254-Y258 PolarHBondContact O-N 2.73Å; L255-Y258 WeakPolarHBondContact O-CB 3.28Å; L255-Y258 PolarHBondContact O-N 3.41Å; Y256-Y258 PolarHBondContact O-N 3.34Å |
| 259 | L | 92.2 | Very high | 87 | Confident | 103 Ų | 103 | 73.7 Ų | 73.7 | 54% | 0.539 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -83.9 | -39.9 | -172.9 | -66.2 | 176 | 0 | 0 | 0 | 113.5 | L255 Y256 | L255-L259 HydrophobicContact CD1-CD1 3.81Å; L255-L259 HydrophobicContact CD1-CG 4.01Å; L255-L259 HydrophobicContact CD2-CD1 4.48Å; L255-L259 HydrophobicContact CG-CD1 3.86Å; L255-L259 HydrophobicContact CG-CG 4.36Å; L255-L259 WeakPolarHBondContact O-CG 3.14Å; L255-L259 PolarHBondContact O-N 3.19Å; Y256-L259 PolarHBondContact O-N 3.44Å |
| 260 | F | 90.6 | Very high | 85.3 | Confident | 133 Ų | 133 | 77 Ų | 77 | 58% | 0.583 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -110.8 | -23.8 | -165 | -63.7 | -77.6 | 0 | 0 | 0 | 114.2 | Y256 R262 | Y256-F260 HydrophobicContact CD1-CB 4.43Å; Y256-F260 HydrophobicContact CD2-CB 4.43Å; Y256-F260 AromaticContact CD2-CD2 3.43Å; Y256-F260 HydrophobicContact CD2-CD2 3.43Å; Y256-F260 VanDerWaalsContact CD2-CD2 3.43Å; Y256-F260 AromaticContact CD2-CE2 4Å; Y256-F260 HydrophobicContact CD2-CE2 4Å; Y256-F260 HydrophobicContact CD2-CG 4.18Å; Y256-F260 HydrophobicContact CE1-CB 4.03Å; Y256-F260 HydrophobicContact CE2-CB 4.02Å; Y256-F260 AromaticContact CE2-CD2 3.55Å; Y256-F260 HydrophobicContact CE2-CD2 3.55Å; Y256-F260 HydrophobicContact CE2-CE2 4.22Å; Y256-F260 AromaticContact CE2-CG 3.87Å; Y256-F260 HydrophobicContact CE2-CG 3.87Å; Y256-F260 AromaticContact CG-CD2 4Å; Y256-F260 HydrophobicContact CG-CD2 4Å; Y256-F260 PolarHBondContact O-N 3.17Å; F260-R262 PolarHBondContact O-N 3.04Å |
| 261 | I | 88.5 | Confident | 83.5 | Confident | 3 Ų | 3 | 78.4 Ų | 78.4 | 2% | 0.015 | 40% | 0.398 | C | S | . | . | P | Polyproline II helix | trans | -79.9 | 118.9 | 178.4 | -61.2 | -178.3 | 0 | 0 | 0 | 109.3 | V55 V58 L148 Y198 A257 | V55-I261 HydrophobicContact CG1-CD1 3.88Å; V58-I261 HydrophobicContact CG2-CD1 3.56Å; L148-I261 HydrophobicContact CD1-CD1 3.57Å; L148-I261 HydrophobicContact CD1-CG2 4.35Å; Y198-I261 HydrophobicContact CD2-CG2 4.43Å; Y198-I261 HydrophobicContact CE2-CG2 3.79Å; A257-I261 HydrophobicContact CB-CD1 3.9Å; A257-I261 WeakPolarHBondContact O-CB 3.39Å |
| 262 | R | 84.4 | Confident | 82 | Confident | 209 Ų | 209 | 84.3 Ų | 84.3 | 79% | 0.789 | 42% | 0.415 | S | S | * | . | P | Polyproline II helix | trans | -80.6 | 147.7 | 171.2 | -65.7 | -176.8 | 179.4 | -177.5 | -1.3 | 108.9 | Y198 F260 S264 | Y198-R262 VanDerWaalsContact CE2-O 3.24Å; Y198-R262 WeakPolarHBondContact CE2-O 3.35Å; Y198-R262 PolarHBondContact OH-O 3.2Å; F260-R262 PolarHBondContact O-N 3.04Å; R262-S264 PolarHBondContact O-N 3.1Å |
| 263 | E | 84.5 | Confident | 80.2 | Confident | 69 Ų | 69 | 85.9 Ų | 85.9 | 32% | 0.322 | 42% | 0.417 | S | S | . | . | P | Polyproline II helix | trans | -69.5 | 127 | 176.7 | -172.9 | 52.8 | -100.8 | 0 | 0 | 110 | G143 R144 R145 V265 P267 | G143-E263 WeakPolarHBondContact CA-OE1 3.48Å; G143-E263 VanDerWaalsContact CA-OE2 3.32Å; G143-E263 WeakPolarHBondContact CA-OE2 3.46Å; R144-E263 PolarHBondContact N-OE1 3.16Å; R144-E263 PolarHBondContact N-OE2 3.15Å; R145-E263 WeakPolarHBondContact CB-OE2 3.26Å; R145-E263 PolarHBondContact N-OE2 2.75Å; E263-V265 WeakPolarHBondContact CG-O 3.32Å; E263-V265 PolarHBondContact OE1-N 3.48Å; E263-P267 HydrophobicContact CG-CG 4.43Å |
| 264 | S | 77.4 | Confident | 78.6 | Confident | 39 Ų | 39 | 92 Ų | 92 | 27% | 0.273 | 45% | 0.449 | S | S | . | . | S | Bend | trans | -89.4 | -26.1 | 178.9 | 62.1 | 0 | 0 | 0 | 0 | 112.1 | R144 D201 R262 | R144-S264 WeakPolarHBondContact CG-OG 3.38Å; D201-S264 PolarHBondContact OD2-OG 3.31Å; D201-S264 VanDerWaalsContact OD2-OG 3.05Å; R262-S264 PolarHBondContact O-N 3.1Å |
| 265 | V | 75.3 | Confident | 77.1 | Confident | 30 Ų | 30 | 93.4 Ų | 93.4 | 18% | 0.182 | 46% | 0.458 | C | S | . | . | S | Bend | trans | -114.1 | 128.5 | -176.3 | 176.1 | 0 | 0 | 0 | 0 | 110 | D140 R144 E263 P267 | D140-V265 WeakPolarHBondContact O-CG1 3.32Å; R144-V265 HydrophobicContact CG-CG2 4.12Å; E263-V265 WeakPolarHBondContact CG-O 3.32Å; E263-V265 PolarHBondContact OE1-N 3.48Å; V265-P267 VanDerWaalsContact O-CD 3.23Å; V265-P267 WeakPolarHBondContact O-CD 3.4Å |
| 266 | R | 69.6 | Low | 75.6 | Confident | 235 Ų | 235 | 92.5 Ų | 92.5 | 89% | 0.887 | 46% | 0.464 | S | S | * | . | P | Polyproline II helix | trans | -64.5 | 118.7 | 175.4 | -68.9 | -174.5 | -178.8 | 179.6 | 0.8 | 109.6 | D268 | R266-D268 PolarHBondContact O-N 2.95Š|
| 267 | P | 70 | Confident | 74.2 | Confident | 84 Ų | 84 | 100.2 Ų | 100.2 | 55% | 0.545 | 49% | 0.493 | S | S | . | . | P | Polyproline II helix | trans | -65 | 123.6 | -177.9 | -20.7 | 32.9 | 0 | 0 | 0 | 110.9 | V141 E263 V265 | V141-P267 WeakPolarHBondContact O-CA 3.44Å; E263-P267 HydrophobicContact CG-CG 4.43Å; V265-P267 VanDerWaalsContact O-CD 3.23Å; V265-P267 WeakPolarHBondContact O-CD 3.4Å |
| 268 | D | 71.6 | Confident | 72.8 | Confident | 75 Ų | 75 | 102.7 Ų | 102.7 | 40% | 0.401 | 50% | 0.504 | S | S | . | . | P | Polyproline II helix | trans | -89 | 121.1 | 169.5 | 178.6 | -11.8 | 0 | 0 | 0 | 109 | V141 R266 S270 A271 | V141-D268 HydrophobicContact CG1-CB 3.7Å; V141-D268 PolarHBondContact O-N 3.35Å; R266-D268 PolarHBondContact O-N 2.95Å; D268-S270 PolarHBondContact O-N 3.14Å; D268-S270 VanDerWaalsContact O-N 3.09Å; D268-S270 WeakPolarHBondContact OD1-CB 3.36Å; D268-S270 PolarHBondContact OD1-N 2.95Å; D268-S270 PolarHBondContact OD1-OG 2.88Å; D268-S270 PolarHBondContact OD2-OG 3.41Å; D268-S270 VanDerWaalsContact OD2-OG 3.05Å; D268-A271 VanDerWaalsContact O-CB 3.26Å; D268-A271 WeakPolarHBondContact O-CB 3.42Å; D268-A271 PolarHBondContact O-N 3.22Å |
| 269 | P | 61.5 | Low | 71.6 | Confident | 135 Ų | 135 | 103 Ų | 103 | 88% | 0.877 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | -12.5 | -179.7 | 24.5 | -32.3 | 0 | 0 | 0 | 114 | A271 | P269-A271 VanDerWaalsContact C-N 3.35Š|
| 270 | S | 61.4 | Low | 70.6 | Confident | 83 Ų | 83 | 104.6 Ų | 104.6 | 58% | 0.58 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.1 | 2.4 | 174.7 | 74.7 | 0 | 0 | 0 | 0 | 114.4 | D268 R272 | D268-S270 PolarHBondContact O-N 3.14Å; D268-S270 VanDerWaalsContact O-N 3.09Å; D268-S270 WeakPolarHBondContact OD1-CB 3.36Å; D268-S270 PolarHBondContact OD1-N 2.95Å; D268-S270 PolarHBondContact OD1-OG 2.88Å; D268-S270 PolarHBondContact OD2-OG 3.41Å; D268-S270 VanDerWaalsContact OD2-OG 3.05Å; S270-R272 PolarHBondContact O-N 3.36Å |
| 271 | A | 60.1 | Low | 69.6 | Low | 30 Ų | 30 | 100 Ų | 100 | 25% | 0.248 | 50% | 0.495 | C | S | . | . | trans | -56.2 | 122.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | V141 A142 D268 P269 | V141-A271 HydrophobicContact CB-CB 4.03Å; V141-A271 HydrophobicContact CG1-CB 3.63Å; A142-A271 HydrophobicContact CB-CB 4.14Å; D268-A271 VanDerWaalsContact O-CB 3.26Å; D268-A271 WeakPolarHBondContact O-CB 3.42Å; D268-A271 PolarHBondContact O-N 3.22Å; P269-A271 VanDerWaalsContact C-N 3.35Å | ||
| 272 | R | 68.1 | Low | 68.7 | Low | 205 Ų | 205 | 101.6 Ų | 101.6 | 77% | 0.774 | 51% | 0.505 | S | S | * | . | trans | -108.9 | 135.7 | 172.2 | -63 | -171.7 | -178.2 | -163.8 | -0.3 | 109.8 | S270 L274 | S270-R272 PolarHBondContact O-N 3.36Å; R272-L274 PolarHBondContact O-N 3.05Å | ||
| 273 | L | 59 | Low | 68.1 | Low | 76 Ų | 76 | 100.6 Ų | 100.6 | 40% | 0.398 | 50% | 0.501 | S | S | . | . | S | Bend | trans | -64.7 | -29.5 | 177.6 | -166.7 | 138.2 | 0 | 0 | 0 | 112.2 | L134 W138 | L134-L273 HydrophobicContact CB-CD2 4.05Å; L134-L273 HydrophobicContact CD1-CD2 4.2Å; W138-L273 HydrophobicContact CD2-CD1 4.47Å; W138-L273 HydrophobicContact CG-CB 4.49Å; W138-L273 HydrophobicContact CG-CG 4.45Å |
| 274 | L | 62.4 | Low | 67.6 | Low | 130 Ų | 130 | 103.2 Ų | 103.2 | 68% | 0.681 | 51% | 0.508 | S | S | * | . | trans | -102.4 | 105.5 | 174.4 | -63.7 | 168.9 | 0 | 0 | 0 | 109.5 | L134 R272 | L134-L274 HydrophobicContact CD1-CD2 3.85Å; L134-L274 HydrophobicContact CD2-CD2 3.79Å; L134-L274 HydrophobicContact CG-CD2 4.47Å; R272-L274 PolarHBondContact O-N 3.05Å | ||
| 275 | S | 64.4 | Low | 67.4 | Low | 40 Ų | 40 | 101.4 Ų | 101.4 | 28% | 0.28 | 50% | 0.495 | S | S | . | . | trans | -128.3 | 118.7 | 175.5 | -177 | 0 | 0 | 0 | 0 | 111.6 | R277 | S275-R277 PolarHBondContact O-N 3.33Š| ||
| 276 | A | 65.1 | Low | 67.3 | Low | 79 Ų | 79 | 101.1 Ų | 101.1 | 65% | 0.653 | 49% | 0.491 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.4 | -6.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | H278 Y279 K280 | A276-H278 VanDerWaalsContact C-N 3.31Å; A276-H278 PolarHBondContact O-N 3.42Å; A276-Y279 PolarHBondContact O-N 3.4Å; A276-K280 PolarHBondContact O-N 2.87Å |
| 277 | R | 65.8 | Low | 67.4 | Low | 209 Ų | 209 | 91.7 Ų | 91.7 | 79% | 0.789 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -61.9 | -38.7 | -177.9 | -66.2 | -175.8 | 179.4 | -173.3 | 0.9 | 112 | S275 A281 | S275-R277 PolarHBondContact O-N 3.33Å; R277-A281 PolarHBondContact O-N 3.05Å; R277-A281 VanDerWaalsContact O-N 3.11Å |
| 278 | H | 64.8 | Low | 67.2 | Low | 52 Ų | 52 | 90.4 Ų | 90.4 | 24% | 0.241 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -66.7 | -48.2 | 179.4 | -94 | 93.5 | 0 | 0 | 0 | 112.5 | S137 D140 A276 K280 A281 V282 | S137-H278 VanDerWaalsContact CB-CE1 3.45Å; S137-H278 WeakPolarHBondContact CB-CE1 3.44Å; S137-H278 WeakPolarHBondContact CB-ND1 3.43Å; D140-H278 IonicContact OD2-CE1 3.49Å; D140-H278 PolarHBondContact OD2-CE1 2.89Å; D140-H278 IonicContact OD2-NE2 3.01Å; A276-H278 VanDerWaalsContact C-N 3.31Å; A276-H278 PolarHBondContact O-N 3.42Å; H278-K280 VanDerWaalsContact C-N 3.29Å; H278-K280 PolarHBondContact O-N 3.17Å; H278-A281 PolarHBondContact O-N 2.95Å; H278-A281 VanDerWaalsContact O-N 3.13Å; H278-V282 WeakPolarHBondContact O-CG2 3.32Å; H278-V282 PolarHBondContact O-N 3.3Å |
| 279 | Y | 67.8 | Low | 66.6 | Low | 145 Ų | 145 | 87 Ų | 87 | 57% | 0.569 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -59.5 | -40.3 | 177.6 | -69.6 | -81.2 | 0 | 0 | 0 | 112.3 | A276 V282 W283 | A276-Y279 PolarHBondContact O-N 3.4Å; Y279-V282 PolarHBondContact O-N 2.8Å; Y279-W283 WeakPolarHBondContact O-CB 3.36Å; Y279-W283 PolarHBondContact O-N 2.96Å |
| 280 | K | 71.4 | Confident | 66.4 | Low | 135 Ų | 135 | 80.5 Ų | 80.5 | 59% | 0.587 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -65.8 | -37.2 | 176.7 | -169.8 | 173.2 | -178.6 | 174.8 | 0 | 112.4 | A276 H278 R284 | A276-K280 PolarHBondContact O-N 2.87Å; H278-K280 VanDerWaalsContact C-N 3.29Å; H278-K280 PolarHBondContact O-N 3.17Å; K280-R284 WeakPolarHBondContact O-CB 3.34Å; K280-R284 PolarHBondContact O-N 3.34Å |
| 281 | A | 67.5 | Low | 66.2 | Low | 38 Ų | 38 | 80.4 Ų | 80.4 | 31% | 0.314 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -69.2 | -43.1 | 177 | 0 | 0 | 0 | 0 | 0 | 112.2 | R277 H278 R284 L285 A429 | R277-A281 PolarHBondContact O-N 3.05Å; R277-A281 VanDerWaalsContact O-N 3.11Å; H278-A281 PolarHBondContact O-N 2.95Å; H278-A281 VanDerWaalsContact O-N 3.13Å; A281-R284 PolarHBondContact O-N 3.37Å; A281-L285 PolarHBondContact O-N 2.87Å; A281-A429 HydrophobicContact CB-CB 3.99Å |
| 282 | V | 70.4 | Confident | 65.7 | Low | 35 Ų | 35 | 82.6 Ų | 82.6 | 21% | 0.212 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -64.8 | -45.1 | 176.3 | 175 | 0 | 0 | 0 | 0 | 111.2 | H278 Y279 R284 L285 Y286 C433 | H278-V282 WeakPolarHBondContact O-CG2 3.32Å; H278-V282 PolarHBondContact O-N 3.3Å; Y279-V282 PolarHBondContact O-N 2.8Å; V282-R284 VanDerWaalsContact C-N 3.32Å; V282-R284 PolarHBondContact O-N 3.48Å; V282-L285 WeakPolarHBondContact O-CB 3.44Å; V282-L285 PolarHBondContact O-N 3.26Å; V282-Y286 HydrophobicContact CG1-CD2 4.41Å; V282-Y286 PolarHBondContact O-N 2.95Å; V282-C433 HydrophobicContact CG1-CB 4.03Å; V282-C433 HydrophobicContact CG2-CB 4.17Å |
| 283 | W | 72.6 | Confident | 64.5 | Low | 189 Ų | 189 | 75.2 Ų | 75.2 | 72% | 0.716 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -61.5 | -42.7 | 176.8 | -179.3 | 77.9 | 0 | 0 | 0 | 111.6 | Y279 L285 S287 | Y279-W283 WeakPolarHBondContact O-CB 3.36Å; Y279-W283 PolarHBondContact O-N 2.96Å; W283-L285 PolarHBondContact O-N 3.13Å; W283-S287 WeakPolarHBondContact O-CB 3.38Å; W283-S287 PolarHBondContact O-N 2.62Å; W283-S287 PolarHBondContact O-OG 3.14Å |
| 284 | R | 74.1 | Confident | 63.7 | Low | 123 Ų | 123 | 77.3 Ų | 77.3 | 46% | 0.464 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -56.8 | -52 | 174.4 | -171.5 | 178.9 | -67.9 | 169.4 | -5.8 | 110.6 | K280 A281 V282 Y286 S287 T288 | K280-R284 WeakPolarHBondContact O-CB 3.34Å; K280-R284 PolarHBondContact O-N 3.34Å; A281-R284 PolarHBondContact O-N 3.37Å; V282-R284 VanDerWaalsContact C-N 3.32Å; V282-R284 PolarHBondContact O-N 3.48Å; R284-Y286 PolarHBondContact O-N 3.43Å; R284-S287 WeakPolarHBondContact CA-OG 3.38Å; R284-S287 PolarHBondContact O-N 3.01Å; R284-S287 VanDerWaalsContact O-N 3.08Å; R284-S287 PolarHBondContact O-OG 3.48Å; R284-T288 HydrophobicContact CG-CG2 4.1Å; R284-T288 PolarHBondContact O-N 3.08Å; R284-T288 PolarHBondContact O-OG1 2.9Å |
| 285 | L | 73.2 | Confident | 62.6 | Low | 1 Ų | 1 | 74.6 Ų | 74.6 | 1% | 0.005 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -51 | -50.2 | -177.8 | -178.1 | 65.9 | 0 | 0 | 0 | 113.4 | A281 V282 W283 G289 G290 V422 E426 L430 | A281-L285 PolarHBondContact O-N 2.87Å; V282-L285 WeakPolarHBondContact O-CB 3.44Å; V282-L285 PolarHBondContact O-N 3.26Å; W283-L285 PolarHBondContact O-N 3.13Å; L285-G289 WeakPolarHBondContact O-CA 3.28Å; L285-G289 PolarHBondContact O-N 3.45Å; L285-G290 PolarHBondContact O-N 3.03Å; L285-V422 HydrophobicContact CD1-CB 4.31Å; L285-V422 HydrophobicContact CD1-CG1 3.46Å; L285-V422 VanDerWaalsContact CD1-CG1 3.46Å; L285-V422 HydrophobicContact CD1-CG2 3.85Å; L285-E426 HydrophobicContact CD1-CB 4.28Å; L285-E426 WeakPolarHBondContact CD1-OE2 3.34Å; L285-L430 HydrophobicContact CD2-CB 3.95Å; L285-L430 HydrophobicContact CD2-CD1 4.07Å |
| 286 | Y | 73.4 | Confident | 61.5 | Low | 24 Ų | 24 | 76.4 Ų | 76.4 | 9% | 0.094 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -79.6 | -24.3 | -179.3 | -77.1 | -92.6 | 0 | 0 | 0 | 113.8 | V282 R284 L306 W307 T310 C433 | V282-Y286 HydrophobicContact CG1-CD2 4.41Å; V282-Y286 PolarHBondContact O-N 2.95Å; R284-Y286 PolarHBondContact O-N 3.43Å; Y286-L306 HydrophobicContact CD1-CD2 4.18Å; Y286-L306 HydrophobicContact CE1-CD2 4.23Å; Y286-L306 HydrophobicContact CE1-CG 4.18Å; Y286-W307 AromaticContact CD1-CD2 3.88Å; Y286-W307 HydrophobicContact CD1-CD2 3.88Å; Y286-W307 AromaticContact CD1-CE2 3.51Å; Y286-W307 HydrophobicContact CD1-CE3 4.24Å; Y286-W307 HydrophobicContact CD1-CG 4.47Å; Y286-W307 AromaticContact CD1-CH2 3.98Å; Y286-W307 HydrophobicContact CD1-CH2 3.98Å; Y286-W307 AromaticContact CD1-CZ2 3.58Å; Y286-W307 HydrophobicContact CD1-CZ2 3.58Å; Y286-W307 HydrophobicContact CD1-CZ3 4.29Å; Y286-W307 AromaticContact CD1-NE1 3.87Å; Y286-W307 HydrophobicContact CE1-CD2 4.23Å; Y286-W307 HydrophobicContact CE1-CE3 4.28Å; Y286-W307 HydrophobicContact CE1-CZ2 4.47Å; Y286-W307 HydrophobicContact CE1-CZ3 4.43Å; Y286-W307 HydrophobicContact CG-CZ2 4.09Å; Y286-T310 HydrophobicContact CE1-CG2 4.32Å; Y286-T310 VanDerWaalsContact OH-CG2 3.29Å; Y286-T310 WeakPolarHBondContact OH-CG2 3.09Å; Y286-T310 PolarHBondContact OH-OG1 3.19Å; Y286-C433 HydrophobicContact CE2-CB 4.3Å; Y286-C433 WeakPolarHBondContact CE2-SG 3.43Å; Y286-C433 PolarHBondContact OH-SG 3.2Å |
| 287 | S | 70.6 | Confident | 60.3 | Low | 38 Ų | 38 | 76 Ų | 76 | 27% | 0.266 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -77.5 | -37.4 | 175.5 | 70.3 | 0 | 0 | 0 | 0 | 112.9 | W283 R284 R303 | W283-S287 WeakPolarHBondContact O-CB 3.38Å; W283-S287 PolarHBondContact O-N 2.62Å; W283-S287 PolarHBondContact O-OG 3.14Å; R284-S287 WeakPolarHBondContact CA-OG 3.38Å; R284-S287 PolarHBondContact O-N 3.01Å; R284-S287 VanDerWaalsContact O-N 3.08Å; R284-S287 PolarHBondContact O-OG 3.48Å; S287-R303 PolarHBondContact O-NH2 3.44Å |
| 288 | T | 65.3 | Low | 59.6 | Low | 57 Ų | 57 | 67.9 Ų | 67.9 | 35% | 0.35 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -99.1 | -13.7 | -177.3 | 59.6 | 0 | 0 | 0 | 0 | 113.5 | R284 G290 | R284-T288 HydrophobicContact CG-CG2 4.1Å; R284-T288 PolarHBondContact O-N 3.08Å; R284-T288 PolarHBondContact O-OG1 2.9Å; T288-G290 VanDerWaalsContact C-N 3.33Å |
| 289 | G | 60.3 | Low | 59.3 | Low | 2 Ų | 2 | 70.6 Ų | 70.6 | 2% | 0.021 | 44% | 0.44 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 80.3 | 13.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | L285 I291 H302 | L285-G289 WeakPolarHBondContact O-CA 3.28Å; L285-G289 PolarHBondContact O-N 3.45Å; G289-I291 PolarHBondContact O-N 2.98Å; G289-H302 PolarHBondContact O-CD2 3.23Å |
| 290 | G | 56.6 | Low | 59.2 | Low | 0 Ų | 0 | 69.1 Ų | 69.1 | 0% | 0 | 45% | 0.448 | C | S | . | . | S | Bend | trans | 79.4 | 12.7 | 171.2 | 0 | 0 | 0 | 0 | 0 | 117.2 | L285 T288 D423 E426 | L285-G290 PolarHBondContact O-N 3.03Å; T288-G290 VanDerWaalsContact C-N 3.33Å; G290-D423 PolarHBondContact O-N 3.35Å; G290-E426 WeakPolarHBondContact CA-OE2 3.23Å |
| 291 | I | 57 | Low | 59.2 | Low | 81 Ų | 81 | 65.9 Ų | 65.9 | 42% | 0.415 | 44% | 0.437 | S | S | . | . | trans | -119.8 | 101.2 | 177.6 | -57.2 | 172.9 | 0 | 0 | 0 | 108.1 | G289 D423 | G289-I291 PolarHBondContact O-N 2.98Å; I291-D423 WeakPolarHBondContact CA-OD2 3.45Å | ||
| 292 | S | 49.1 | Very low | 59.6 | Low | 75 Ų | 75 | 66.3 Ų | 66.3 | 52% | 0.524 | 43% | 0.432 | S | S | . | . | trans | -104.6 | 32.7 | -179.9 | -64 | 0 | 0 | 0 | 0 | 111.2 | D423 E426 | S292-D423 PolarHBondContact N-OD2 3.23Å; S292-E426 PolarHBondContact OG-OE1 3.47Å | ||
| 293 | G | 44.8 | Very low | 60.1 | Low | 50 Ų | 50 | 69.5 Ų | 69.5 | 52% | 0.515 | 44% | 0.44 | S | S | . | . | S | Bend | trans | -97.8 | 131 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | G295 | G293-G295 PolarHBondContact O-N 3.49Š|
| 294 | A | 40.4 | Very low | 60.6 | Low | 121 Ų | 121 | 62 Ų | 62 | 100% | 1 | 42% | 0.421 | S | S | * | . | S | Bend | trans | -57.9 | 98 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 295 | G | 40 | Very low | 61.3 | Low | 72 Ų | 72 | 57.4 Ų | 57.4 | 74% | 0.742 | 41% | 0.405 | S | S | * | . | S | Bend | trans | 164.3 | 65.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | G293 | G293-G295 PolarHBondContact O-N 3.49Š|
| 296 | G | 40.3 | Very low | 62 | Low | 79 Ų | 79 | 57.4 Ų | 57.4 | 81% | 0.814 | 41% | 0.405 | S | S | * | . | S | Bend | trans | 57.5 | 97.5 | 153.8 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||
| 297 | G | 41.7 | Very low | 62.7 | Low | 71 Ų | 71 | 63.2 Ų | 63.2 | 73% | 0.732 | 43% | 0.427 | S | S | * | . | trans | 68.3 | 93 | 152.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | E299 | G297-E299 PolarHBondContact O-N 3.5Š| ||
| 298 | G | 50.3 | Low | 63.8 | Low | 37 Ų | 37 | 64.4 Ų | 64.4 | 38% | 0.381 | 43% | 0.43 | S | S | . | . | trans | -52.3 | 114.6 | 166.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 299 | E | 59.1 | Low | 65.1 | Low | 109 Ų | 109 | 62.1 Ų | 62.1 | 51% | 0.509 | 42% | 0.415 | S | S | . | . | trans | -50.6 | 131.9 | -175.9 | -72 | -157 | 107.8 | 0 | 0 | 109 | G297 L301 H302 R489 | G297-E299 PolarHBondContact O-N 3.5Å; E299-L301 HydrophobicContact CB-CB 4.48Å; E299-L301 PolarHBondContact O-N 3.42Å; E299-H302 PolarHBondContact O-N 2.92Å; E299-R489 IonicContact OE2-NH2 2.87Å | ||
| 300 | P | 65.5 | Low | 66.6 | Low | 114 Ų | 114 | 62.8 Ų | 62.8 | 74% | 0.74 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -54 | -25.5 | 179.8 | 18.6 | -30.2 | 0 | 0 | 0 | 112.4 | G304 | P300-G304 PolarHBondContact O-N 2.89Å |
| 301 | L | 71.1 | Confident | 68.4 | Low | 67 Ų | 67 | 66.4 Ų | 66.4 | 35% | 0.351 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -63.7 | -40.7 | 174.2 | -169 | 66.8 | 0 | 0 | 0 | 113.4 | E299 G304 K305 F485 | E299-L301 HydrophobicContact CB-CB 4.48Å; E299-L301 PolarHBondContact O-N 3.42Å; L301-G304 PolarHBondContact O-N 3.32Å; L301-K305 WeakPolarHBondContact O-CG 3.21Å; L301-K305 PolarHBondContact O-N 3.36Å; L301-F485 HydrophobicContact CD1-CE1 4.43Å; L301-F485 HydrophobicContact CD2-CE1 4Å; L301-F485 HydrophobicContact CD2-CZ 4.5Å |
| 302 | H | 76.7 | Confident | 70.3 | Confident | 48 Ų | 48 | 62.6 Ų | 62.6 | 22% | 0.222 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -69.2 | -41.5 | -179.2 | -164.9 | 85.3 | 0 | 0 | 0 | 111.4 | G289 E299 K305 L306 L421 | G289-H302 PolarHBondContact O-CD2 3.23Å; E299-H302 PolarHBondContact O-N 2.92Å; H302-K305 PolarHBondContact O-N 3.42Å; H302-L306 PolarHBondContact O-N 3.4Å; H302-L306 VanDerWaalsContact O-N 3.07Å; H302-L421 PolarHBondContact NE2-O 3Å |
| 303 | R | 79.3 | Confident | 72.4 | Confident | 102 Ų | 102 | 59 Ų | 59 | 39% | 0.385 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -62 | -43.3 | 172.6 | -67.5 | 179.6 | 67.6 | -167.3 | -0.2 | 111.7 | S287 K305 L306 W307 | S287-R303 PolarHBondContact O-NH2 3.44Å; R303-K305 VanDerWaalsContact C-N 3.35Å; R303-K305 PolarHBondContact O-N 3.31Å; R303-L306 PolarHBondContact O-N 2.71Å; R303-W307 PolarHBondContact O-N 2.59Å; R303-W307 VanDerWaalsContact O-N 3.14Å |
| 304 | G | 84.3 | Confident | 74.9 | Confident | 30 Ų | 30 | 58.9 Ų | 58.9 | 31% | 0.309 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -57.9 | -45.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | P300 L301 L306 W307 L308 | P300-G304 PolarHBondContact O-N 2.89Å; L301-G304 PolarHBondContact O-N 3.32Å; G304-L306 PolarHBondContact O-N 2.87Å; G304-W307 PolarHBondContact O-N 3.5Å; G304-L308 WeakPolarHBondContact O-CB 3.36Å; G304-L308 VanDerWaalsContact O-CG 3.23Å; G304-L308 WeakPolarHBondContact O-CG 3.45Å; G304-L308 PolarHBondContact O-N 3.43Å |
| 305 | K | 87.5 | Confident | 77.5 | Confident | 28 Ų | 28 | 54.4 Ų | 54.4 | 12% | 0.122 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -59.9 | -44.6 | 176.5 | -73.5 | -176.7 | 179.2 | -164.1 | 0 | 112.4 | L301 H302 R303 W307 L308 Y309 L421 L482 D486 | L301-K305 WeakPolarHBondContact O-CG 3.21Å; L301-K305 PolarHBondContact O-N 3.36Å; H302-K305 PolarHBondContact O-N 3.42Å; R303-K305 VanDerWaalsContact C-N 3.35Å; R303-K305 PolarHBondContact O-N 3.31Å; K305-W307 PolarHBondContact O-N 2.93Å; K305-L308 PolarHBondContact O-N 2.97Å; K305-Y309 WeakPolarHBondContact O-CD2 3.39Å; K305-Y309 PolarHBondContact O-N 2.87Å; K305-L421 HydrophobicContact CB-CD1 4.25Å; K305-L421 HydrophobicContact CB-CD2 4.48Å; K305-L482 HydrophobicContact CG-CD2 4.12Å; K305-D486 VanDerWaalsContact NZ-CG 3.28Å; K305-D486 IonicContact NZ-OD1 3.77Å; K305-D486 PolarHBondContact NZ-OD1 3.43Å; K305-D486 IonicContact NZ-OD2 3.98Å; K305-D486 PolarHBondContact NZ-OD2 2.92Å; K305-D486 VanDerWaalsContact NZ-OD2 3.13Å |
| 306 | L | 88 | Confident | 80.2 | Confident | 1 Ų | 1 | 51 Ų | 51 | 1% | 0.005 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.6 | -48 | 178.6 | -176.5 | 68.1 | 0 | 0 | 0 | 111.8 | Y286 H302 R303 G304 T310 L418 L421 V422 L430 | Y286-L306 HydrophobicContact CD1-CD2 4.18Å; Y286-L306 HydrophobicContact CE1-CD2 4.23Å; Y286-L306 HydrophobicContact CE1-CG 4.18Å; H302-L306 PolarHBondContact O-N 3.4Å; H302-L306 VanDerWaalsContact O-N 3.07Å; R303-L306 PolarHBondContact O-N 2.71Å; G304-L306 PolarHBondContact O-N 2.87Å; L306-T310 WeakPolarHBondContact O-CB 3.3Å; L306-T310 PolarHBondContact O-N 3.03Å; L306-T310 PolarHBondContact O-OG1 3.01Å; L306-L418 HydrophobicContact CD1-CD2 3.89Å; L306-L421 HydrophobicContact CD1-CB 4.38Å; L306-V422 HydrophobicContact CD1-CG2 4.1Å; L306-L430 HydrophobicContact CD1-CD1 4.46Å |
| 307 | W | 89.9 | Confident | 82.7 | Confident | 146 Ų | 146 | 47.3 Ų | 47.3 | 55% | 0.553 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -63.2 | -43.7 | 176.8 | -83.8 | 105.7 | 0 | 0 | 0 | 112.5 | Y286 R303 G304 K305 T310 L311 | Y286-W307 AromaticContact CD1-CD2 3.88Å; Y286-W307 HydrophobicContact CD1-CD2 3.88Å; Y286-W307 AromaticContact CD1-CE2 3.51Å; Y286-W307 HydrophobicContact CD1-CE3 4.24Å; Y286-W307 HydrophobicContact CD1-CG 4.47Å; Y286-W307 AromaticContact CD1-CH2 3.98Å; Y286-W307 HydrophobicContact CD1-CH2 3.98Å; Y286-W307 AromaticContact CD1-CZ2 3.58Å; Y286-W307 HydrophobicContact CD1-CZ2 3.58Å; Y286-W307 HydrophobicContact CD1-CZ3 4.29Å; Y286-W307 AromaticContact CD1-NE1 3.87Å; Y286-W307 HydrophobicContact CE1-CD2 4.23Å; Y286-W307 HydrophobicContact CE1-CE3 4.28Å; Y286-W307 HydrophobicContact CE1-CZ2 4.47Å; Y286-W307 HydrophobicContact CE1-CZ3 4.43Å; Y286-W307 HydrophobicContact CG-CZ2 4.09Å; R303-W307 PolarHBondContact O-N 2.59Å; R303-W307 VanDerWaalsContact O-N 3.14Å; G304-W307 PolarHBondContact O-N 3.5Å; K305-W307 PolarHBondContact O-N 2.93Å; W307-T310 PolarHBondContact O-N 3.29Å; W307-L311 WeakPolarHBondContact O-CB 3.03Å; W307-L311 PolarHBondContact O-N 3.39Å |
| 308 | L | 93 | Very high | 85.2 | Confident | 63 Ų | 63 | 44.3 Ų | 44.3 | 33% | 0.33 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -62.1 | -46.5 | 178.6 | -74.4 | 171.7 | 0 | 0 | 0 | 112.2 | G304 K305 T310 L311 C312 I478 L482 | G304-L308 WeakPolarHBondContact O-CB 3.36Å; G304-L308 VanDerWaalsContact O-CG 3.23Å; G304-L308 WeakPolarHBondContact O-CG 3.45Å; G304-L308 PolarHBondContact O-N 3.43Å; K305-L308 PolarHBondContact O-N 2.97Å; L308-T310 VanDerWaalsContact C-N 3.32Å; L308-T310 PolarHBondContact O-N 3.24Å; L308-L311 PolarHBondContact O-N 3.18Å; L308-C312 PolarHBondContact O-N 3.2Å; L308-C312 PolarHBondContact O-SG 3.33Å; L308-I478 HydrophobicContact CB-CG2 3.96Å; L308-I478 HydrophobicContact CD1-CG2 4.49Å; L308-I478 HydrophobicContact CD2-CD1 4.22Å; L308-I478 HydrophobicContact CD2-CG2 4.11Å; L308-I478 HydrophobicContact CG-CG2 4.42Å; L308-L482 HydrophobicContact CB-CD1 4.35Å; L308-L482 HydrophobicContact CD1-CD1 4.33Å; L308-L482 HydrophobicContact CD1-CD2 4.15Å |
| 309 | Y | 92.5 | Very high | 87.4 | Confident | 9 Ų | 9 | 42.7 Ų | 42.7 | 4% | 0.035 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -67.5 | -32.8 | 177.1 | -78.8 | -63.6 | 0 | 0 | 0 | 112.8 | K305 C312 F313 L414 K417 L421 I479 L482 | K305-Y309 WeakPolarHBondContact O-CD2 3.39Å; K305-Y309 PolarHBondContact O-N 2.87Å; Y309-C312 PolarHBondContact O-N 3.35Å; Y309-F313 WeakPolarHBondContact O-CB 3.5Å; Y309-F313 PolarHBondContact O-N 3.02Å; Y309-L414 HydrophobicContact CD1-CD2 3.72Å; Y309-L414 HydrophobicContact CE1-CD2 4.36Å; Y309-K417 HydrophobicContact CD1-CB 4.26Å; Y309-K417 HydrophobicContact CE1-CB 4.16Å; Y309-K417 HydrophobicContact CE1-CG 4.23Å; Y309-K417 HydrophobicContact CG-CB 4.49Å; Y309-L421 HydrophobicContact CD2-CD1 3.59Å; Y309-L421 HydrophobicContact CE2-CD1 4.12Å; Y309-I479 HydrophobicContact CE1-CG1 4.41Å; Y309-L482 HydrophobicContact CD2-CD1 4.39Å; Y309-L482 HydrophobicContact CE1-CD1 4.33Å; Y309-L482 HydrophobicContact CE2-CD1 3.87Å |
| 310 | T | 92 | Very high | 89 | Confident | 15 Ų | 15 | 37.9 Ų | 37.9 | 9% | 0.092 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -66.6 | -42.2 | 174.4 | -56.5 | 0 | 0 | 0 | 0 | 110.8 | Y286 L306 W307 L308 F313 F314 L418 V437 | Y286-T310 HydrophobicContact CE1-CG2 4.32Å; Y286-T310 VanDerWaalsContact OH-CG2 3.29Å; Y286-T310 WeakPolarHBondContact OH-CG2 3.09Å; Y286-T310 PolarHBondContact OH-OG1 3.19Å; L306-T310 WeakPolarHBondContact O-CB 3.3Å; L306-T310 PolarHBondContact O-N 3.03Å; L306-T310 PolarHBondContact O-OG1 3.01Å; W307-T310 PolarHBondContact O-N 3.29Å; L308-T310 VanDerWaalsContact C-N 3.32Å; L308-T310 PolarHBondContact O-N 3.24Å; T310-F313 PolarHBondContact O-N 2.7Å; T310-F314 WeakPolarHBondContact O-CB 3.28Å; T310-F314 PolarHBondContact O-N 3.01Å; T310-L418 WeakPolarHBondContact OG1-CD2 3.36Å; T310-V437 HydrophobicContact CG2-CG2 4.25Å |
| 311 | L | 94.9 | Very high | 90.1 | Very high | 77 Ų | 77 | 34.8 Ų | 34.8 | 40% | 0.403 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -61.8 | -45 | 172.9 | 178.3 | 63.9 | 0 | 0 | 0 | 111.3 | W307 L308 F313 F314 L315 I478 | W307-L311 WeakPolarHBondContact O-CB 3.03Å; W307-L311 PolarHBondContact O-N 3.39Å; L308-L311 PolarHBondContact O-N 3.18Å; L311-F313 VanDerWaalsContact C-N 3.34Å; L311-F313 PolarHBondContact O-N 3.3Å; L311-F314 WeakPolarHBondContact O-CB 3.43Å; L311-F314 PolarHBondContact O-N 2.88Å; L311-L315 HydrophobicContact CD1-CD1 4.24Å; L311-L315 HydrophobicContact CD1-CG 4.15Å; L311-L315 HydrophobicContact CG-CD1 4.16Å; L311-L315 HydrophobicContact CG-CG 4.45Å; L311-L315 WeakPolarHBondContact O-CG 3.05Å; L311-L315 PolarHBondContact O-N 3.3Å; L311-I478 HydrophobicContact CD2-CD1 4.32Å |
| 312 | C | 95.8 | Very high | 91 | Very high | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -58.9 | -45.9 | 175.5 | -69.6 | 0 | 0 | 0 | 0 | 111.7 | L308 Y309 F314 L315 V316 L414 P475 | L308-C312 PolarHBondContact O-N 3.2Å; L308-C312 PolarHBondContact O-SG 3.33Å; Y309-C312 PolarHBondContact O-N 3.35Å; C312-F314 VanDerWaalsContact C-N 3.33Å; C312-F314 PolarHBondContact O-N 3.39Å; C312-L315 PolarHBondContact O-N 3.46Å; C312-V316 WeakPolarHBondContact O-CB 3.47Å; C312-V316 WeakPolarHBondContact O-CG2 3.28Å; C312-V316 PolarHBondContact O-N 2.99Å; C312-L414 HydrophobicContact CB-CD1 4.25Å; C312-L414 HydrophobicContact CB-CD2 3.8Å; C312-P475 HydrophobicContact CB-CB 3.87Å |
| 313 | F | 94.3 | Very high | 91.8 | Very high | 1 Ų | 1 | 29.5 Ų | 29.5 | 0% | 0.004 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -58.9 | -46.6 | 176.2 | -178.5 | -92.2 | 0 | 0 | 0 | 111.1 | Y309 T310 L311 V316 V317 T411 L414 L418 V434 V437 E438 | Y309-F313 WeakPolarHBondContact O-CB 3.5Å; Y309-F313 PolarHBondContact O-N 3.02Å; T310-F313 PolarHBondContact O-N 2.7Å; L311-F313 VanDerWaalsContact C-N 3.34Å; L311-F313 PolarHBondContact O-N 3.3Å; F313-V316 PolarHBondContact O-N 3.43Å; F313-V317 HydrophobicContact CD1-CG2 4.29Å; F313-V317 HydrophobicContact CD2-CG2 4.28Å; F313-V317 HydrophobicContact CE1-CG2 3.96Å; F313-V317 HydrophobicContact CE2-CG2 3.95Å; F313-V317 HydrophobicContact CG-CG2 4.43Å; F313-V317 HydrophobicContact CZ-CG2 3.77Å; F313-V317 WeakPolarHBondContact O-CB 3.25Å; F313-V317 VanDerWaalsContact O-CG2 3.27Å; F313-V317 WeakPolarHBondContact O-CG2 3.12Å; F313-V317 PolarHBondContact O-N 3.05Å; F313-T411 HydrophobicContact CD2-CG2 4.49Å; F313-T411 HydrophobicContact CE2-CG2 3.77Å; F313-L414 HydrophobicContact CB-CB 4.46Å; F313-L414 HydrophobicContact CD2-CB 4.15Å; F313-L418 HydrophobicContact CB-CD1 4.29Å; F313-V434 HydrophobicContact CD1-CG1 4.43Å; F313-V434 HydrophobicContact CE1-CG1 3.69Å; F313-V434 HydrophobicContact CE2-CG1 4.13Å; F313-V434 HydrophobicContact CZ-CG1 3.51Å; F313-V437 HydrophobicContact CD1-CG1 3.93Å; F313-V437 HydrophobicContact CE1-CG1 4.3Å; F313-E438 HydrophobicContact CE1-CB 4.3Å |
| 314 | F | 95.6 | Very high | 92.3 | Very high | 47 Ų | 47 | 27.5 Ų | 27.5 | 21% | 0.206 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -58.4 | -51.7 | 177.7 | 176.4 | -93.1 | 0 | 0 | 0 | 112.5 | T310 L311 C312 V316 V317 A318 V437 L440 C441 V444 | T310-F314 WeakPolarHBondContact O-CB 3.28Å; T310-F314 PolarHBondContact O-N 3.01Å; L311-F314 WeakPolarHBondContact O-CB 3.43Å; L311-F314 PolarHBondContact O-N 2.88Å; C312-F314 VanDerWaalsContact C-N 3.33Å; C312-F314 PolarHBondContact O-N 3.39Å; F314-V316 PolarHBondContact O-N 3.46Å; F314-V317 PolarHBondContact O-N 3.03Å; F314-A318 WeakPolarHBondContact O-CB 3.28Å; F314-A318 PolarHBondContact O-N 3.06Å; F314-V437 HydrophobicContact CB-CG1 4.03Å; F314-V437 HydrophobicContact CD2-CG1 4.02Å; F314-L440 HydrophobicContact CE2-CB 4.49Å; F314-L440 HydrophobicContact CE2-CD2 4.03Å; F314-L440 HydrophobicContact CE2-CG 4Å; F314-C441 VanDerWaalsContact CA-SG 3.57Å; F314-C441 WeakPolarHBondContact CD2-SG 3.07Å; F314-C441 PolarHBondContact O-SG 2.92Å; F314-C441 VanDerWaalsContact O-SG 3.37Å; F314-V444 HydrophobicContact CE2-CG2 4.45Å; F314-V444 HydrophobicContact CZ-CB 4.01Å; F314-V444 HydrophobicContact CZ-CG1 3.93Å; F314-V444 HydrophobicContact CZ-CG2 4.03Å |
| 315 | L | 96.8 | Very high | 92.4 | Very high | 27 Ų | 27 | 27.8 Ų | 27.8 | 14% | 0.141 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -62.9 | -44.3 | -178.3 | -67 | 176.8 | 0 | 0 | 0 | 112 | L311 C312 V319 V471 I474 P475 | L311-L315 HydrophobicContact CD1-CD1 4.24Å; L311-L315 HydrophobicContact CD1-CG 4.15Å; L311-L315 HydrophobicContact CG-CD1 4.16Å; L311-L315 HydrophobicContact CG-CG 4.45Å; L311-L315 WeakPolarHBondContact O-CG 3.05Å; L311-L315 PolarHBondContact O-N 3.3Å; C312-L315 PolarHBondContact O-N 3.46Å; L315-V319 WeakPolarHBondContact O-CB 3.47Å; L315-V319 VanDerWaalsContact O-CG2 3.28Å; L315-V319 WeakPolarHBondContact O-CG2 3.38Å; L315-V319 PolarHBondContact O-N 2.93Å; L315-V471 HydrophobicContact CB-CG1 4.36Å; L315-V471 HydrophobicContact CD2-CG1 4.01Å; L315-I474 HydrophobicContact CD1-CB 4.06Å; L315-I474 HydrophobicContact CD1-CG2 3.83Å; L315-P475 HydrophobicContact CB-CG 4.49Å |
| 316 | V | 95.7 | Very high | 92.6 | Very high | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -63.3 | -49 | -179.8 | 170.6 | 0 | 0 | 0 | 0 | 111 | C312 F313 F314 V319 H320 L378 L414 L472 P475 | C312-V316 WeakPolarHBondContact O-CB 3.47Å; C312-V316 WeakPolarHBondContact O-CG2 3.28Å; C312-V316 PolarHBondContact O-N 2.99Å; F313-V316 PolarHBondContact O-N 3.43Å; F314-V316 PolarHBondContact O-N 3.46Å; V316-V319 PolarHBondContact O-N 3.45Å; V316-H320 WeakPolarHBondContact CG1-CE1 3.33Å; V316-H320 PolarHBondContact O-N 2.99Å; V316-H320 PolarHBondContact O-ND1 2.96Å; V316-L378 HydrophobicContact CG2-CD2 3.77Å; V316-L414 HydrophobicContact CB-CD1 4.35Å; V316-L414 HydrophobicContact CG2-CD1 4.09Å; V316-L472 HydrophobicContact CB-CD2 4.49Å; V316-L472 HydrophobicContact CG2-CD2 4.04Å; V316-P475 HydrophobicContact CG2-CB 4.06Å; V316-P475 HydrophobicContact CG2-CG 3.89Å |
| 317 | V | 93.3 | Very high | 92.9 | Very high | 2 Ų | 2 | 27 Ų | 27 | 1% | 0.012 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -68.2 | -42.4 | -179.1 | 176.4 | 0 | 0 | 0 | 0 | 111.1 | F313 F314 V319 H320 F321 T411 E438 C441 F442 | F313-V317 HydrophobicContact CD1-CG2 4.29Å; F313-V317 HydrophobicContact CD2-CG2 4.28Å; F313-V317 HydrophobicContact CE1-CG2 3.96Å; F313-V317 HydrophobicContact CE2-CG2 3.95Å; F313-V317 HydrophobicContact CG-CG2 4.43Å; F313-V317 HydrophobicContact CZ-CG2 3.77Å; F313-V317 WeakPolarHBondContact O-CB 3.25Å; F313-V317 VanDerWaalsContact O-CG2 3.27Å; F313-V317 WeakPolarHBondContact O-CG2 3.12Å; F313-V317 PolarHBondContact O-N 3.05Å; F314-V317 PolarHBondContact O-N 3.03Å; V317-V319 VanDerWaalsContact C-N 3.32Å; V317-V319 PolarHBondContact O-N 3.03Å; V317-H320 PolarHBondContact O-N 2.62Å; V317-F321 HydrophobicContact CG1-CD2 3.75Å; V317-F321 HydrophobicContact CG1-CE2 3.94Å; V317-F321 WeakPolarHBondContact O-CD2 3.22Å; V317-F321 PolarHBondContact O-N 3.48Å; V317-T411 HydrophobicContact CG2-CG2 4.2Å; V317-E438 HydrophobicContact CG1-CG 4.18Å; V317-C441 HydrophobicContact CB-CB 4.07Å; V317-C441 HydrophobicContact CG1-CB 3.63Å; V317-F442 HydrophobicContact CG1-CD1 4.38Å; V317-F442 HydrophobicContact CG1-CE1 3.82Å |
| 318 | A | 94.8 | Very high | 93.1 | Very high | 8 Ų | 8 | 20.4 Ų | 20.4 | 7% | 0.066 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -60.2 | -41.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | F314 G322 C441 G445 | F314-A318 WeakPolarHBondContact O-CB 3.28Å; F314-A318 PolarHBondContact O-N 3.06Å; A318-G322 PolarHBondContact O-N 3.48Å; A318-C441 HydrophobicContact CB-CB 4.1Å; A318-G445 WeakPolarHBondContact O-CA 3.1Å |
| 319 | V | 96.2 | Very high | 93.1 | Very high | 2 Ų | 2 | 17.4 Ų | 17.4 | 1% | 0.012 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -65.2 | -46.4 | 174.6 | 167.5 | 0 | 0 | 0 | 0 | 111.5 | L315 V316 V317 F321 G322 T323 L385 F449 A468 V471 L472 | L315-V319 WeakPolarHBondContact O-CB 3.47Å; L315-V319 VanDerWaalsContact O-CG2 3.28Å; L315-V319 WeakPolarHBondContact O-CG2 3.38Å; L315-V319 PolarHBondContact O-N 2.93Å; V316-V319 PolarHBondContact O-N 3.45Å; V317-V319 VanDerWaalsContact C-N 3.32Å; V317-V319 PolarHBondContact O-N 3.03Å; V319-F321 PolarHBondContact O-N 2.85Å; V319-G322 PolarHBondContact O-N 3.36Å; V319-T323 HydrophobicContact CG1-CG2 4.19Å; V319-T323 WeakPolarHBondContact O-CB 3.4Å; V319-T323 WeakPolarHBondContact O-CG2 3.19Å; V319-T323 PolarHBondContact O-N 3.38Å; V319-T323 PolarHBondContact O-OG1 2.95Å; V319-L385 HydrophobicContact CG1-CD1 4.15Å; V319-F449 HydrophobicContact CG2-CE2 4.42Å; V319-F449 HydrophobicContact CG2-CZ 4.21Å; V319-A468 HydrophobicContact CG1-CB 3.71Å; V319-V471 HydrophobicContact CG2-CB 4.13Å; V319-V471 HydrophobicContact CG2-CG1 3.76Å; V319-L472 HydrophobicContact CB-CD2 4.01Å; V319-L472 HydrophobicContact CB-CG 4.29Å; V319-L472 HydrophobicContact CG1-CD1 3.87Å; V319-L472 HydrophobicContact CG1-CD2 4.11Å; V319-L472 HydrophobicContact CG1-CG 3.92Å; V319-L472 HydrophobicContact CG2-CD2 4.09Å; V319-L472 HydrophobicContact CG2-CG 4.23Å |
| 320 | H | 92.3 | Very high | 93.2 | Very high | 9 Ų | 9 | 17.1 Ų | 17.1 | 4% | 0.042 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -58.1 | -47.4 | -179.7 | -72.5 | 152.2 | 0 | 0 | 0 | 112.7 | V316 V317 T323 R324 N381 F407 M408 | V316-H320 WeakPolarHBondContact CG1-CE1 3.33Å; V316-H320 PolarHBondContact O-N 2.99Å; V316-H320 PolarHBondContact O-ND1 2.96Å; V317-H320 PolarHBondContact O-N 2.62Å; H320-T323 PolarHBondContact O-OG1 3.32Å; H320-R324 WeakPolarHBondContact O-CB 3.44Å; H320-R324 PolarHBondContact O-N 2.94Å; H320-N381 PolarHBondContact CD2-ND2 3.24Å; H320-N381 VanDerWaalsContact CD2-ND2 3.34Å; H320-N381 PolarHBondContact NE2-ND2 3.35Å; H320-F407 AromaticContact CD2-CD2 3.37Å; H320-F407 WeakPolarHBondContact CD2-CD2 3.34Å; H320-F407 AromaticContact CD2-CE2 3.86Å; H320-F407 PolarHBondContact CE1-O 2.93Å; H320-F407 AromaticContact NE2-CD2 3.43Å; H320-F407 WeakPolarHBondContact NE2-CD2 3.38Å; H320-F407 PolarHBondContact NE2-O 2.9Å; H320-M408 HydrophobicContact CB-CE 3.78Å |
| 321 | F | 87.8 | Confident | 93.2 | Very high | 49 Ų | 49 | 16.4 Ų | 16.4 | 22% | 0.215 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -75.8 | -41.3 | -178.8 | -80.6 | -91.1 | 0 | 0 | 0 | 112.2 | V317 V319 R324 F442 | V317-F321 HydrophobicContact CG1-CD2 3.75Å; V317-F321 HydrophobicContact CG1-CE2 3.94Å; V317-F321 WeakPolarHBondContact O-CD2 3.22Å; V317-F321 PolarHBondContact O-N 3.48Å; V319-F321 PolarHBondContact O-N 2.85Å; F321-R324 WeakPolarHBondContact O-CB 3.34Å; F321-R324 PolarHBondContact O-N 3.47Å; F321-F442 HydrophobicContact CB-CD1 3.94Å; F321-F442 HydrophobicContact CB-CE1 4.37Å; F321-F442 AromaticContact CD1-CD1 3.77Å; F321-F442 HydrophobicContact CD1-CD1 3.77Å; F321-F442 HydrophobicContact CD1-CD2 4.28Å; F321-F442 AromaticContact CD1-CE1 3.66Å; F321-F442 HydrophobicContact CD1-CE1 3.66Å; F321-F442 HydrophobicContact CD1-CE2 4.08Å; F321-F442 HydrophobicContact CD1-CG 4.16Å; F321-F442 AromaticContact CD1-CZ 3.84Å; F321-F442 HydrophobicContact CD1-CZ 3.84Å; F321-F442 AromaticContact CD2-CD1 3.61Å; F321-F442 HydrophobicContact CD2-CD1 3.61Å; F321-F442 AromaticContact CD2-CE1 3.16Å; F321-F442 HydrophobicContact CD2-CE1 3.16Å; F321-F442 AromaticContact CD2-CZ 3.91Å; F321-F442 HydrophobicContact CD2-CZ 3.91Å; F321-F442 HydrophobicContact CE1-CD1 4.16Å; F321-F442 HydrophobicContact CE1-CD2 4.31Å; F321-F442 AromaticContact CE1-CE1 3.61Å; F321-F442 HydrophobicContact CE1-CE1 3.61Å; F321-F442 AromaticContact CE1-CE2 3.67Å; F321-F442 HydrophobicContact CE1-CE2 3.67Å; F321-F442 AromaticContact CE1-CZ 3.35Å; F321-F442 HydrophobicContact CE1-CZ 3.35Å; F321-F442 HydrophobicContact CE2-CD1 4.02Å; F321-F442 AromaticContact CE2-CE1 3.11Å; F321-F442 HydrophobicContact CE2-CE1 3.11Å; F321-F442 AromaticContact CE2-CZ 3.43Å; F321-F442 HydrophobicContact CE2-CZ 3.43Å; F321-F442 VanDerWaalsContact CE2-CZ 3.43Å; F321-F442 AromaticContact CG-CD1 3.46Å; F321-F442 HydrophobicContact CG-CD1 3.46Å; F321-F442 VanDerWaalsContact CG-CD1 3.46Å; F321-F442 AromaticContact CG-CE1 3.45Å; F321-F442 HydrophobicContact CG-CE1 3.45Å; F321-F442 VanDerWaalsContact CG-CE1 3.45Å; F321-F442 HydrophobicContact CG-CG 4.24Å; F321-F442 HydrophobicContact CG-CZ 4.1Å; F321-F442 HydrophobicContact CZ-CD1 4.28Å; F321-F442 AromaticContact CZ-CE1 3.34Å; F321-F442 HydrophobicContact CZ-CE1 3.34Å; F321-F442 AromaticContact CZ-CE2 3.91Å; F321-F442 HydrophobicContact CZ-CE2 3.91Å; F321-F442 AromaticContact CZ-CZ 3.12Å; F321-F442 HydrophobicContact CZ-CZ 3.12Å |
| 322 | G | 91.4 | Very high | 93 | Very high | 0 Ų | 0 | 13.6 Ų | 13.6 | 0% | 0 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -65.4 | -43.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | A318 V319 R324 E325 | A318-G322 PolarHBondContact O-N 3.48Å; V319-G322 PolarHBondContact O-N 3.36Å; G322-R324 VanDerWaalsContact C-N 3.28Å; G322-R324 PolarHBondContact O-N 2.93Å; G322-E325 PolarHBondContact O-N 2.98Å |
| 323 | T | 93.1 | Very high | 92.6 | Very high | 3 Ų | 3 | 13.6 Ų | 13.6 | 2% | 0.018 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -67.9 | -28.7 | 176 | 55.7 | 0 | 0 | 0 | 0 | 112.6 | V319 H320 E325 L326 Y327 L385 F449 F465 A468 | V319-T323 HydrophobicContact CG1-CG2 4.19Å; V319-T323 WeakPolarHBondContact O-CB 3.4Å; V319-T323 WeakPolarHBondContact O-CG2 3.19Å; V319-T323 PolarHBondContact O-N 3.38Å; V319-T323 PolarHBondContact O-OG1 2.95Å; H320-T323 PolarHBondContact O-OG1 3.32Å; T323-E325 VanDerWaalsContact C-N 3.27Å; T323-E325 PolarHBondContact O-N 3.35Å; T323-L326 PolarHBondContact O-N 3.31Å; T323-L326 VanDerWaalsContact O-N 3.09Å; T323-Y327 WeakPolarHBondContact O-CD2 3.35Å; T323-Y327 PolarHBondContact O-N 3.01Å; T323-L385 HydrophobicContact CG2-CD2 3.96Å; T323-F449 HydrophobicContact CG2-CD1 4.27Å; T323-F449 HydrophobicContact CG2-CE1 3.94Å; T323-F449 HydrophobicContact CG2-CZ 4.11Å; T323-F465 HydrophobicContact CG2-CD1 4.2Å; T323-A468 HydrophobicContact CG2-CB 3.51Å |
| 324 | R | 89.7 | Confident | 92 | Very high | 61 Ų | 61 | 15.8 Ų | 15.8 | 23% | 0.23 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -59.8 | -35.7 | 177.7 | -167.9 | 179.5 | -172.4 | -157.1 | 4.6 | 113 | H320 F321 G322 L326 L350 N351 | H320-R324 WeakPolarHBondContact O-CB 3.44Å; H320-R324 PolarHBondContact O-N 2.94Å; F321-R324 WeakPolarHBondContact O-CB 3.34Å; F321-R324 PolarHBondContact O-N 3.47Å; G322-R324 VanDerWaalsContact C-N 3.28Å; G322-R324 PolarHBondContact O-N 2.93Å; R324-L326 VanDerWaalsContact C-N 3.27Å; R324-L326 PolarHBondContact O-N 2.96Å; R324-L350 HydrophobicContact CG-CD2 4.05Å; R324-N351 PolarHBondContact NH2-OD1 3.43Å |
| 325 | E | 85.7 | Confident | 91.4 | Very high | 36 Ų | 36 | 16.2 Ų | 16.2 | 17% | 0.168 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -72.3 | -20.9 | 178.7 | -64.9 | -164.9 | 137.6 | 0 | 0 | 113.1 | S121 G322 T323 S446 N450 | S121-E325 WeakPolarHBondContact CB-OE1 3.28Å; S121-E325 PolarHBondContact OG-OE1 2.62Å; G322-E325 PolarHBondContact O-N 2.98Å; T323-E325 VanDerWaalsContact C-N 3.27Å; T323-E325 PolarHBondContact O-N 3.35Å; E325-S446 WeakPolarHBondContact OE2-CA 3.42Å; E325-S446 WeakPolarHBondContact OE2-CB 3.49Å; E325-S446 PolarHBondContact OE2-OG 3.45Å; E325-N450 PolarHBondContact OE2-ND2 2.95Å |
| 326 | L | 92.3 | Very high | 90.9 | Very high | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -88.9 | -25.5 | -177.9 | -61.7 | -174 | 0 | 0 | 0 | 114 | T323 R324 V328 L329 Y330 F449 Y453 S464 F465 | T323-L326 PolarHBondContact O-N 3.31Å; T323-L326 VanDerWaalsContact O-N 3.09Å; R324-L326 VanDerWaalsContact C-N 3.27Å; R324-L326 PolarHBondContact O-N 2.96Å; L326-V328 PolarHBondContact O-N 2.76Å; L326-L329 PolarHBondContact O-N 3.31Å; L326-Y330 WeakPolarHBondContact O-CB 3.23Å; L326-Y330 PolarHBondContact O-N 2.83Å; L326-F449 HydrophobicContact CD1-CB 3.87Å; L326-F449 HydrophobicContact CD1-CD1 4.07Å; L326-F449 HydrophobicContact CD1-CG 4.41Å; L326-F449 HydrophobicContact CG-CB 4.22Å; L326-Y453 HydrophobicContact CD1-CD2 4.13Å; L326-Y453 HydrophobicContact CD1-CG 4.4Å; L326-Y453 HydrophobicContact CD2-CD1 4.42Å; L326-Y453 HydrophobicContact CD2-CD2 4.29Å; L326-Y453 HydrophobicContact CD2-CG 3.9Å; L326-S464 VanDerWaalsContact CD1-CB 3.44Å; L326-F465 HydrophobicContact CB-CE1 4.21Å; L326-F465 HydrophobicContact CB-CZ 4.02Å |
| 327 | Y | 94.3 | Very high | 90.5 | Very high | 11 Ų | 11 | 17.2 Ų | 17.2 | 4% | 0.043 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -52.7 | -56.4 | -175.1 | -77.1 | -56.4 | 0 | 0 | 0 | 112.5 | T323 L329 Y330 E331 L350 F388 Y401 F465 | T323-Y327 WeakPolarHBondContact O-CD2 3.35Å; T323-Y327 PolarHBondContact O-N 3.01Å; Y327-L329 VanDerWaalsContact C-N 3.3Å; Y327-L329 PolarHBondContact O-N 3.07Å; Y327-Y330 PolarHBondContact O-N 3.22Å; Y327-Y330 VanDerWaalsContact O-N 3.13Å; Y327-E331 WeakPolarHBondContact CB-OE1 3.47Å; Y327-E331 WeakPolarHBondContact O-CB 3.28Å; Y327-E331 VanDerWaalsContact O-CD 3.31Å; Y327-E331 WeakPolarHBondContact O-CG 3.47Å; Y327-E331 PolarHBondContact O-N 3.42Å; Y327-L350 HydrophobicContact CD2-CD2 3.78Å; Y327-L350 HydrophobicContact CE2-CD1 4.04Å; Y327-L350 HydrophobicContact CE2-CD2 3.81Å; Y327-F388 HydrophobicContact CE1-CD1 4.4Å; Y327-F388 AromaticContact CE1-CD2 3.64Å; Y327-F388 HydrophobicContact CE1-CD2 3.64Å; Y327-F388 HydrophobicContact CE1-CE1 4.31Å; Y327-F388 AromaticContact CE1-CE2 3.6Å; Y327-F388 HydrophobicContact CE1-CE2 3.6Å; Y327-F388 HydrophobicContact CE1-CG 4.07Å; Y327-F388 AromaticContact CE1-CZ 3.94Å; Y327-F388 HydrophobicContact CE1-CZ 3.94Å; Y327-F388 AromaticContact CZ-CE2 3.83Å; Y327-F388 VanDerWaalsContact OH-CE2 3.29Å; Y327-F388 WeakPolarHBondContact OH-CE2 3.46Å; Y327-Y401 HydrophobicContact CD1-CE1 4.4Å; Y327-Y401 HydrophobicContact CE1-CE1 4.44Å; Y327-F465 AromaticContact CD1-CE1 3.94Å; Y327-F465 HydrophobicContact CD1-CE1 3.94Å; Y327-F465 AromaticContact CD1-CZ 3.96Å; Y327-F465 HydrophobicContact CD1-CZ 3.96Å; Y327-F465 HydrophobicContact CE1-CD1 4.43Å; Y327-F465 AromaticContact CE1-CE1 3.72Å; Y327-F465 HydrophobicContact CE1-CE1 3.72Å; Y327-F465 HydrophobicContact CE1-CZ 4.14Å |
| 328 | V | 94.7 | Very high | 90.4 | Very high | 9 Ų | 9 | 17.5 Ų | 17.5 | 6% | 0.055 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -61.2 | -40.3 | -177.6 | 179.1 | 0 | 0 | 0 | 0 | 111.5 | P71 T74 Q75 L326 E331 L332 I343 | P71-V328 HydrophobicContact CB-CG2 3.95Å; P71-V328 HydrophobicContact CG-CG2 4.48Å; T74-V328 HydrophobicContact CG2-CB 4.1Å; T74-V328 HydrophobicContact CG2-CG1 3.8Å; Q75-V328 HydrophobicContact CG-CG1 4.02Å; L326-V328 PolarHBondContact O-N 2.76Å; V328-E331 PolarHBondContact O-N 2.96Å; V328-L332 HydrophobicContact CG1-CD1 3.94Å; V328-L332 HydrophobicContact CG1-CG 4.44Å; V328-L332 WeakPolarHBondContact O-CB 3.25Å; V328-L332 WeakPolarHBondContact O-CD1 3.29Å; V328-L332 VanDerWaalsContact O-CG 3.25Å; V328-L332 WeakPolarHBondContact O-CG 3.47Å; V328-L332 PolarHBondContact O-N 3.03Å; V328-I343 HydrophobicContact CG1-CD1 4.44Å; V328-I343 HydrophobicContact CG1-CG2 3.98Å; V328-I343 HydrophobicContact CG2-CG2 4.05Å |
| 329 | L | 92.8 | Very high | 90.2 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -66.2 | -42.5 | 178 | -176.5 | 60.1 | 0 | 0 | 0 | 111.4 | T74 W78 T113 A114 L326 Y327 S333 Y453 | T74-L329 HydrophobicContact CG2-CB 4.49Å; W78-L329 HydrophobicContact CE3-CD1 3.6Å; W78-L329 HydrophobicContact CZ3-CD1 3.64Å; T113-L329 HydrophobicContact CG2-CD1 3.77Å; A114-L329 HydrophobicContact CB-CD2 3.77Å; L326-L329 PolarHBondContact O-N 3.31Å; Y327-L329 VanDerWaalsContact C-N 3.3Å; Y327-L329 PolarHBondContact O-N 3.07Å; L329-S333 VanDerWaalsContact O-CB 3.3Å; L329-S333 WeakPolarHBondContact O-CB 3.39Å; L329-S333 PolarHBondContact O-N 3.01Å; L329-S333 PolarHBondContact O-OG 2.92Å; L329-Y453 HydrophobicContact CD2-CD1 3.74Å; L329-Y453 HydrophobicContact CD2-CE1 3.52Å; L329-Y453 HydrophobicContact CG-CE1 3.89Å |
| 330 | Y | 93.1 | Very high | 90 | Very high | 3 Ų | 3 | 20.2 Ų | 20.2 | 1% | 0.012 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -64.9 | -40.5 | 177.5 | -173.1 | -86.3 | 0 | 0 | 0 | 111.9 | L326 Y327 S333 L336 F388 A391 M397 Y453 K461 F465 | L326-Y330 WeakPolarHBondContact O-CB 3.23Å; L326-Y330 PolarHBondContact O-N 2.83Å; Y327-Y330 PolarHBondContact O-N 3.22Å; Y327-Y330 VanDerWaalsContact O-N 3.13Å; Y330-S333 PolarHBondContact O-N 2.9Å; Y330-L336 HydrophobicContact CD1-CD1 3.79Å; Y330-L336 HydrophobicContact CE1-CD1 3.71Å; Y330-F388 PolarHBondContact OH-O 3.3Å; Y330-A391 HydrophobicContact CE1-CB 4.33Å; Y330-A391 WeakPolarHBondContact CE1-O 3.46Å; Y330-A391 PolarHBondContact OH-O 3.39Å; Y330-M397 HydrophobicContact CD1-CE 3.33Å; Y330-M397 HydrophobicContact CE1-CE 3.69Å; Y330-M397 HydrophobicContact CG-CE 4.46Å; Y330-Y453 HydrophobicContact CD2-CE2 4.11Å; Y330-K461 HydrophobicContact CD2-CD 4.2Å; Y330-K461 HydrophobicContact CD2-CG 3.94Å; Y330-K461 HydrophobicContact CE2-CB 4.36Å; Y330-K461 HydrophobicContact CE2-CD 3.99Å; Y330-K461 HydrophobicContact CE2-CG 3.75Å; Y330-K461 PolarHBondContact O-NZ 3.36Å; Y330-F465 HydrophobicContact CD1-CE2 4.26Å; Y330-F465 HydrophobicContact CD2-CD2 4.4Å; Y330-F465 AromaticContact CD2-CE2 3.65Å; Y330-F465 HydrophobicContact CD2-CE2 3.65Å; Y330-F465 HydrophobicContact CE2-CD2 4.49Å; Y330-F465 HydrophobicContact CE2-CE2 4.12Å; Y330-F465 AromaticContact CG-CE2 3.72Å; Y330-F465 HydrophobicContact CG-CE2 3.72Å; Y330-F465 HydrophobicContact CG-CZ 4.37Å |
| 331 | E | 93.2 | Very high | 90 | Very high | 0 Ų | 0 | 20.2 Ų | 20.2 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -66.3 | -40.5 | 177.4 | -70.7 | 159.9 | -150.3 | 0 | 0 | 113.2 | Y327 V328 S333 L336 C337 W338 I343 M397 Y401 | Y327-E331 WeakPolarHBondContact CB-OE1 3.47Å; Y327-E331 WeakPolarHBondContact O-CB 3.28Å; Y327-E331 VanDerWaalsContact O-CD 3.31Å; Y327-E331 WeakPolarHBondContact O-CG 3.47Å; Y327-E331 PolarHBondContact O-N 3.42Å; V328-E331 PolarHBondContact O-N 2.96Å; E331-S333 PolarHBondContact O-N 3.43Å; E331-L336 WeakPolarHBondContact O-CB 3.35Å; E331-C337 PolarHBondContact O-N 3.4Å; E331-W338 HydrophobicContact CB-CB 4.29Å; E331-W338 HydrophobicContact CB-CD2 4.07Å; E331-W338 HydrophobicContact CB-CE3 3.74Å; E331-W338 HydrophobicContact CB-CG 4.32Å; E331-W338 HydrophobicContact CB-CZ3 4.45Å; E331-W338 HydrophobicContact CG-CD2 4.09Å; E331-W338 HydrophobicContact CG-CE3 3.48Å; E331-W338 VanDerWaalsContact CG-CE3 3.48Å; E331-W338 HydrophobicContact CG-CH2 4.46Å; E331-W338 HydrophobicContact CG-CZ3 3.69Å; E331-W338 PolarHBondContact O-N 2.9Å; E331-I343 HydrophobicContact CB-CG1 4.2Å; E331-M397 HydrophobicContact CG-CE 3.75Å; E331-Y401 PolarHBondContact OE1-OH 2.8Å |
| 332 | L | 90.3 | Very high | 90.3 | Very high | 17 Ų | 17 | 20.3 Ų | 20.3 | 9% | 0.089 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -65.6 | -27.1 | 176.7 | -80.1 | 166.5 | 0 | 0 | 0 | 113.1 | T74 Q75 W78 V328 I343 | T74-L332 HydrophobicContact CG2-CD1 4.5Å; Q75-L332 HydrophobicContact CG-CD1 3.99Å; Q75-L332 HydrophobicContact CG-CD2 4.24Å; Q75-L332 HydrophobicContact CG-CG 4.49Å; W78-L332 HydrophobicContact CB-CD1 3.95Å; W78-L332 HydrophobicContact CD2-CB 4.24Å; W78-L332 HydrophobicContact CD2-CD1 4.27Å; W78-L332 HydrophobicContact CE3-CB 4.38Å; W78-L332 HydrophobicContact CG-CD1 4.01Å; V328-L332 HydrophobicContact CG1-CD1 3.94Å; V328-L332 HydrophobicContact CG1-CG 4.44Å; V328-L332 WeakPolarHBondContact O-CB 3.25Å; V328-L332 WeakPolarHBondContact O-CD1 3.29Å; V328-L332 VanDerWaalsContact O-CG 3.25Å; V328-L332 WeakPolarHBondContact O-CG 3.47Å; V328-L332 PolarHBondContact O-N 3.03Å; L332-I343 HydrophobicContact CD2-CD1 3.54Å; L332-I343 HydrophobicContact CG-CD1 3.71Å |
| 333 | S | 86.9 | Confident | 90.5 | Very high | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 11% | 0.112 | C | C | . | . | S | Bend | trans | -94.2 | 152.9 | -168.1 | -62.8 | 0 | 0 | 0 | 0 | 111.9 | W78 E110 L329 Y330 E331 L336 C337 K461 | W78-S333 WeakPolarHBondContact CH2-OG 3.32Å; W78-S333 VanDerWaalsContact CZ3-OG 3.23Å; W78-S333 WeakPolarHBondContact CZ3-OG 3.08Å; E110-S333 VanDerWaalsContact CD-OG 3.29Å; E110-S333 WeakPolarHBondContact CG-OG 3.13Å; E110-S333 WeakPolarHBondContact OE1-CB 3.17Å; E110-S333 PolarHBondContact OE1-OG 3.35Å; L329-S333 VanDerWaalsContact O-CB 3.3Å; L329-S333 WeakPolarHBondContact O-CB 3.39Å; L329-S333 PolarHBondContact O-N 3.01Å; L329-S333 PolarHBondContact O-OG 2.92Å; Y330-S333 PolarHBondContact O-N 2.9Å; E331-S333 PolarHBondContact O-N 3.43Å; S333-L336 PolarHBondContact O-N 2.98Å; S333-L336 VanDerWaalsContact O-N 3.15Å; S333-C337 PolarHBondContact O-N 2.87Å; S333-K461 VanDerWaalsContact C-NZ 3.29Å; S333-K461 PolarHBondContact O-NZ 3.28Å; S333-K461 VanDerWaalsContact O-NZ 3.17Å |
| 334 | S | 81.8 | Confident | 90.6 | Very high | 48 Ų | 48 | 20.3 Ų | 20.3 | 34% | 0.336 | 11% | 0.112 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -55.9 | 134.7 | 176.2 | -177.6 | 0 | 0 | 0 | 0 | 111.9 | Q106 C337 K461 | Q106-S334 VanDerWaalsContact NE2-CB 3.27Å; S334-C337 WeakPolarHBondContact CA-SG 3.25Å; S334-C337 PolarHBondContact N-SG 3.44Å; S334-C337 VanDerWaalsContact N-SG 3.43Å; S334-K461 PolarHBondContact O-NZ 2.89Å |
| 335 | P | 82.4 | Confident | 90.9 | Very high | 55 Ų | 55 | 22.5 Ų | 22.5 | 36% | 0.357 | 12% | 0.122 | S | C | . | . | T | Hydrogen-bonded Turn | cis | -92.2 | -5 | 13.6 | 35.6 | -37.9 | 0 | 0 | 0 | 116.3 | H392 | P335-H392 HydrophobicContact CG-CB 3.89Å; P335-H392 VanDerWaalsContact CG-O 3.29Å; P335-H392 WeakPolarHBondContact CG-O 3.33Å |
| 336 | L | 86.9 | Confident | 91.4 | Very high | 16 Ų | 16 | 20.8 Ų | 20.8 | 8% | 0.084 | 11% | 0.114 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75.9 | -49 | -171.5 | -70.4 | 173.2 | 0 | 0 | 0 | 112.4 | Y330 E331 S333 W338 M397 | Y330-L336 HydrophobicContact CD1-CD1 3.79Å; Y330-L336 HydrophobicContact CE1-CD1 3.71Å; E331-L336 WeakPolarHBondContact O-CB 3.35Å; S333-L336 PolarHBondContact O-N 2.98Å; S333-L336 VanDerWaalsContact O-N 3.15Å; L336-W338 HydrophobicContact CB-CG 4.42Å; L336-W338 PolarHBondContact O-N 3.41Å; L336-W338 VanDerWaalsContact O-N 3.16Å; L336-M397 HydrophobicContact CD1-CE 3.48Å; L336-M397 VanDerWaalsContact CD1-CE 3.48Å |
| 337 | C | 87.2 | Confident | 91.5 | Very high | 33 Ų | 33 | 21.4 Ų | 21.4 | 22% | 0.223 | 12% | 0.118 | C | C | . | . | trans | 46.9 | 47.2 | 176.6 | -54.4 | 0 | 0 | 0 | 0 | 112.7 | C95 E331 S333 S334 | C95-C337 HydrophobicContact CB-CB 3.82Å; C95-C337 WeakPolarHBondContact CB-SG 3.31Å; C95-C337 WeakPolarHBondContact SG-CB 3.28Å; C95-C337 CovalentContact SG-SG 2.01Å; C95-C337 PolarHBondContact SG-SG 3.33Å; E331-C337 PolarHBondContact O-N 3.4Å; S333-C337 PolarHBondContact O-N 2.87Å; S334-C337 WeakPolarHBondContact CA-SG 3.25Å; S334-C337 PolarHBondContact N-SG 3.44Å; S334-C337 VanDerWaalsContact N-SG 3.43Å | ||
| 338 | W | 91.6 | Very high | 91.6 | Very high | 8 Ų | 8 | 21.2 Ų | 21.2 | 3% | 0.03 | 12% | 0.119 | C | C | . | . | trans | -65.2 | 140.2 | -177.5 | -77.3 | 6.5 | 0 | 0 | 0 | 111.2 | E331 L336 L342 I343 T394 M397 F398 Y401 | E331-W338 HydrophobicContact CB-CB 4.29Å; E331-W338 HydrophobicContact CB-CD2 4.07Å; E331-W338 HydrophobicContact CB-CE3 3.74Å; E331-W338 HydrophobicContact CB-CG 4.32Å; E331-W338 HydrophobicContact CB-CZ3 4.45Å; E331-W338 HydrophobicContact CG-CD2 4.09Å; E331-W338 HydrophobicContact CG-CE3 3.48Å; E331-W338 VanDerWaalsContact CG-CE3 3.48Å; E331-W338 HydrophobicContact CG-CH2 4.46Å; E331-W338 HydrophobicContact CG-CZ3 3.69Å; E331-W338 PolarHBondContact O-N 2.9Å; L336-W338 HydrophobicContact CB-CG 4.42Å; L336-W338 PolarHBondContact O-N 3.41Å; L336-W338 VanDerWaalsContact O-N 3.16Å; W338-L342 HydrophobicContact CB-CB 3.85Å; W338-L342 HydrophobicContact CD2-CB 3.8Å; W338-L342 HydrophobicContact CE3-CB 3.98Å; W338-L342 HydrophobicContact CG-CB 3.77Å; W338-L342 HydrophobicContact CG-CD1 4.26Å; W338-I343 HydrophobicContact CB-CD1 4.43Å; W338-I343 HydrophobicContact CB-CG1 3.85Å; W338-I343 HydrophobicContact CE3-CG1 4.3Å; W338-T394 HydrophobicContact CZ2-CG2 3.66Å; W338-T394 PolarHBondContact NE1-OG1 3.12Å; W338-M397 HydrophobicContact CH2-CB 3.99Å; W338-M397 HydrophobicContact CH2-CG 3.44Å; W338-M397 VanDerWaalsContact CH2-CG 3.44Å; W338-M397 HydrophobicContact CZ2-CB 3.78Å; W338-M397 HydrophobicContact CZ2-CG 3.71Å; W338-M397 HydrophobicContact CZ3-CG 4.28Å; W338-F398 HydrophobicContact CH2-CD2 4.29Å; W338-F398 AromaticContact CH2-CE2 3.83Å; W338-F398 HydrophobicContact CH2-CE2 3.83Å; W338-F398 HydrophobicContact CH2-CZ 4.12Å; W338-F398 HydrophobicContact CZ2-CD2 4.32Å; W338-F398 AromaticContact CZ2-CE2 3.97Å; W338-F398 HydrophobicContact CZ2-CE2 3.97Å; W338-Y401 HydrophobicContact CH2-CE2 4.06Å; W338-Y401 HydrophobicContact CZ3-CE2 4.41Å | ||
| 339 | D | 90.6 | Very high | 91.6 | Very high | 61 Ų | 61 | 22.1 Ų | 22.1 | 33% | 0.326 | 13% | 0.127 | S | C | . | . | trans | -76.8 | 174 | 168 | 66.1 | 22.4 | 0 | 0 | 0 | 111.3 | R235 A341 L342 I343 | R235-D339 IonicContact CZ-OD2 2.82Å; R235-D339 VanDerWaalsContact NH1-CG 3.35Å; R235-D339 IonicContact NH1-OD1 3.95Å; R235-D339 IonicContact NH1-OD2 3.97Å; R235-D339 PolarHBondContact NH1-OD2 3.2Å; D339-A341 PolarHBondContact O-N 2.72Å; D339-A341 WeakPolarHBondContact OD1-CB 3.21Å; D339-A341 PolarHBondContact OD1-N 3.33Å; D339-A341 VanDerWaalsContact OD1-N 3.12Å; D339-L342 PolarHBondContact O-N 3.48Å; D339-L342 PolarHBondContact OD1-N 3.36Å; D339-I343 WeakPolarHBondContact O-CG1 3.17Å; D339-I343 PolarHBondContact O-N 2.94Å; D339-I343 VanDerWaalsContact O-N 3.09Å | ||
| 340 | S | 91.3 | Very high | 91.6 | Very high | 6 Ų | 6 | 22.8 Ų | 22.8 | 4% | 0.042 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -58.6 | -31 | -179.3 | 65.4 | 0 | 0 | 0 | 0 | 114 | G231 R234 R235 G344 | G231-S340 CarbonylContact C-O 3.58Å; G231-S340 WeakPolarHBondContact CA-O 3.43Å; G231-S340 CarbonylContact O-C 3.57Å; G231-S340 VanDerWaalsContact O-CB 3.3Å; G231-S340 WeakPolarHBondContact O-CB 3.41Å; G231-S340 PolarHBondContact O-OG 3.31Å; R234-S340 VanDerWaalsContact CD-CB 3.46Å; R234-S340 VanDerWaalsContact NH1-CB 3.33Å; R235-S340 WeakPolarHBondContact CB-OG 3.37Å; R235-S340 PolarHBondContact N-OG 3.03Å; S340-G344 PolarHBondContact O-N 3.47Å |
| 341 | A | 93 | Very high | 91.6 | Very high | 8 Ų | 8 | 22.9 Ų | 22.9 | 7% | 0.066 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -72.9 | -46.3 | -177.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | D339 G344 Y345 | D339-A341 PolarHBondContact O-N 2.72Å; D339-A341 WeakPolarHBondContact OD1-CB 3.21Å; D339-A341 PolarHBondContact OD1-N 3.33Å; D339-A341 VanDerWaalsContact OD1-N 3.12Å; A341-G344 WeakPolarHBondContact O-CA 3.35Å; A341-G344 PolarHBondContact O-N 3.48Å; A341-Y345 VanDerWaalsContact O-CD2 3.25Å; A341-Y345 WeakPolarHBondContact O-CD2 3.45Å; A341-Y345 PolarHBondContact O-N 3.02Å |
| 342 | L | 94.5 | Very high | 91.6 | Very high | 51 Ų | 51 | 26.8 Ų | 26.8 | 27% | 0.267 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -61.9 | -44 | 175.4 | -85.2 | 161.2 | 0 | 0 | 0 | 112.2 | W338 D339 G344 Y345 G346 T394 F398 | W338-L342 HydrophobicContact CB-CB 3.85Å; W338-L342 HydrophobicContact CD2-CB 3.8Å; W338-L342 HydrophobicContact CE3-CB 3.98Å; W338-L342 HydrophobicContact CG-CB 3.77Å; W338-L342 HydrophobicContact CG-CD1 4.26Å; D339-L342 PolarHBondContact O-N 3.48Å; D339-L342 PolarHBondContact OD1-N 3.36Å; L342-G344 VanDerWaalsContact C-N 3.25Å; L342-G344 PolarHBondContact O-N 2.96Å; L342-Y345 PolarHBondContact O-N 3.11Å; L342-Y345 VanDerWaalsContact O-N 3.1Å; L342-G346 PolarHBondContact O-N 2.94Å; L342-T394 HydrophobicContact CD2-CG2 3.86Å; L342-F398 HydrophobicContact CD2-CE2 4.1Å |
| 343 | I | 95.1 | Very high | 91.6 | Very high | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -58.4 | -41 | 173.3 | -66.8 | 166.7 | 0 | 0 | 0 | 110.7 | P71 Q75 V328 E331 L332 W338 D339 G346 S347 | P71-I343 HydrophobicContact CB-CG2 4.21Å; Q75-I343 HydrophobicContact CG-CD1 3.98Å; V328-I343 HydrophobicContact CG1-CD1 4.44Å; V328-I343 HydrophobicContact CG1-CG2 3.98Å; V328-I343 HydrophobicContact CG2-CG2 4.05Å; E331-I343 HydrophobicContact CB-CG1 4.2Å; L332-I343 HydrophobicContact CD2-CD1 3.54Å; L332-I343 HydrophobicContact CG-CD1 3.71Å; W338-I343 HydrophobicContact CB-CD1 4.43Å; W338-I343 HydrophobicContact CB-CG1 3.85Å; W338-I343 HydrophobicContact CE3-CG1 4.3Å; D339-I343 WeakPolarHBondContact O-CG1 3.17Å; D339-I343 PolarHBondContact O-N 2.94Å; D339-I343 VanDerWaalsContact O-N 3.09Å; I343-G346 PolarHBondContact O-N 3.39Å; I343-S347 VanDerWaalsContact O-CB 3.27Å; I343-S347 WeakPolarHBondContact O-CB 3.46Å; I343-S347 PolarHBondContact O-N 3.24Å; I343-S347 PolarHBondContact O-OG 3.5Å |
| 344 | G | 95.8 | Very high | 91.7 | Very high | 3 Ų | 3 | 27.5 Ų | 27.5 | 3% | 0.031 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -59.6 | -44.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | S227 S340 A341 L342 A348 | S227-G344 WeakPolarHBondContact CB-O 3.26Å; S227-G344 VanDerWaalsContact O-CA 3.26Å; S227-G344 WeakPolarHBondContact O-CA 3.14Å; S340-G344 PolarHBondContact O-N 3.47Å; A341-G344 WeakPolarHBondContact O-CA 3.35Å; A341-G344 PolarHBondContact O-N 3.48Å; L342-G344 VanDerWaalsContact C-N 3.25Å; L342-G344 PolarHBondContact O-N 2.96Å; G344-A348 VanDerWaalsContact O-CB 3.22Å; G344-A348 WeakPolarHBondContact O-CB 3.3Å; G344-A348 PolarHBondContact O-N 3.38Å |
| 345 | Y | 96.1 | Very high | 92.2 | Very high | 108 Ų | 108 | 27.5 Ų | 27.5 | 42% | 0.424 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -68.3 | -40.7 | 176.5 | -63.8 | -45 | 0 | 0 | 0 | 113.2 | I228 Q232 A341 L342 A348 A349 | I228-Y345 HydrophobicContact CG1-CD1 4.48Å; I228-Y345 HydrophobicContact CG2-CE1 4.48Å; Q232-Y345 PolarHBondContact NE2-OH 3.09Å; A341-Y345 VanDerWaalsContact O-CD2 3.25Å; A341-Y345 WeakPolarHBondContact O-CD2 3.45Å; A341-Y345 PolarHBondContact O-N 3.02Å; L342-Y345 PolarHBondContact O-N 3.11Å; L342-Y345 VanDerWaalsContact O-N 3.1Å; Y345-A348 WeakPolarHBondContact O-CB 3.41Å; Y345-A348 PolarHBondContact O-N 3.37Å; Y345-A349 PolarHBondContact O-N 3.48Å |
| 346 | G | 95.2 | Very high | 92.6 | Very high | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -63.6 | -47.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L342 I343 A348 A349 L350 Y401 | L342-G346 PolarHBondContact O-N 2.94Å; I343-G346 PolarHBondContact O-N 3.39Å; G346-A348 VanDerWaalsContact C-N 3.28Å; G346-A348 PolarHBondContact O-N 2.94Å; G346-A349 WeakPolarHBondContact O-CB 3.35Å; G346-A349 PolarHBondContact O-N 3.5Å; G346-L350 PolarHBondContact O-N 2.97Å; G346-Y401 VanDerWaalsContact CA-CE2 3.43Å |
| 347 | S | 95.4 | Very high | 92.8 | Very high | 13 Ų | 13 | 25.9 Ų | 25.9 | 9% | 0.091 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -60.4 | -38.2 | 173.7 | -65.3 | 0 | 0 | 0 | 0 | 111.8 | S227 I343 L350 N351 | S227-S347 WeakPolarHBondContact OG-CB 3.44Å; I343-S347 VanDerWaalsContact O-CB 3.27Å; I343-S347 WeakPolarHBondContact O-CB 3.46Å; I343-S347 PolarHBondContact O-N 3.24Å; I343-S347 PolarHBondContact O-OG 3.5Å; S347-L350 PolarHBondContact O-N 3.36Å; S347-N351 PolarHBondContact O-N 3.49Å; S347-N351 VanDerWaalsContact O-N 3.07Å; S347-N351 PolarHBondContact O-ND2 3.03Å |
| 348 | A | 95.9 | Very high | 92.9 | Very high | 7 Ų | 7 | 27 Ų | 27 | 6% | 0.058 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -65 | -41.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | M224 I228 G344 Y345 G346 L350 N351 L352 | M224-A348 HydrophobicContact CG-CB 4.01Å; I228-A348 HydrophobicContact CD1-CB 4.13Å; I228-A348 HydrophobicContact CG1-CB 3.63Å; G344-A348 VanDerWaalsContact O-CB 3.22Å; G344-A348 WeakPolarHBondContact O-CB 3.3Å; G344-A348 PolarHBondContact O-N 3.38Å; Y345-A348 WeakPolarHBondContact O-CB 3.41Å; Y345-A348 PolarHBondContact O-N 3.37Å; G346-A348 VanDerWaalsContact C-N 3.28Å; G346-A348 PolarHBondContact O-N 2.94Å; A348-L350 VanDerWaalsContact C-N 3.33Å; A348-L350 PolarHBondContact O-N 2.92Å; A348-N351 PolarHBondContact O-N 3.19Å; A348-L352 WeakPolarHBondContact O-CB 3.21Å; A348-L352 PolarHBondContact O-N 3.49Å |
| 349 | A | 95 | Very high | 92.9 | Very high | 27 Ų | 27 | 32 Ų | 32 | 22% | 0.223 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -61.2 | -41 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y345 G346 L352 A353 Y401 | Y345-A349 PolarHBondContact O-N 3.48Å; G346-A349 WeakPolarHBondContact O-CB 3.35Å; G346-A349 PolarHBondContact O-N 3.5Å; A349-L352 PolarHBondContact O-N 2.98Å; A349-A353 PolarHBondContact O-N 3.45Å; A349-Y401 HydrophobicContact CB-CD2 4.01Å; A349-Y401 HydrophobicContact CB-CG 3.98Å |
| 350 | L | 92.5 | Very high | 92.8 | Very high | 15 Ų | 15 | 29.7 Ų | 29.7 | 8% | 0.079 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -64.1 | -41.1 | 175.4 | -171.1 | 71.1 | 0 | 0 | 0 | 112.4 | R324 Y327 G346 S347 A348 A353 Y401 F407 | R324-L350 HydrophobicContact CG-CD2 4.05Å; Y327-L350 HydrophobicContact CD2-CD2 3.78Å; Y327-L350 HydrophobicContact CE2-CD1 4.04Å; Y327-L350 HydrophobicContact CE2-CD2 3.81Å; G346-L350 PolarHBondContact O-N 2.97Å; S347-L350 PolarHBondContact O-N 3.36Å; A348-L350 VanDerWaalsContact C-N 3.33Å; A348-L350 PolarHBondContact O-N 2.92Å; L350-A353 WeakPolarHBondContact O-CB 3.36Å; L350-A353 PolarHBondContact O-N 3.32Å; L350-Y401 HydrophobicContact CB-CE1 4.49Å; L350-F407 HydrophobicContact CD1-CE1 4.41Å; L350-F407 HydrophobicContact CD1-CZ 4.13Å |
| 351 | N | 92.8 | Very high | 92.6 | Very high | 4 Ų | 4 | 30.6 Ų | 30.6 | 2% | 0.021 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -72.3 | -33.6 | 177.2 | -71.2 | -71.4 | 0 | 0 | 0 | 112.3 | G220 G223 M224 S227 R324 S347 A348 A353 Y354 | G220-N351 WeakPolarHBondContact CA-O 3.32Å; G223-N351 PolarHBondContact O-ND2 2.91Å; M224-N351 HydrophobicContact CB-CB 4.37Å; S227-N351 PolarHBondContact OG-ND2 3.37Å; R324-N351 PolarHBondContact NH2-OD1 3.43Å; S347-N351 PolarHBondContact O-N 3.49Å; S347-N351 VanDerWaalsContact O-N 3.07Å; S347-N351 PolarHBondContact O-ND2 3.03Å; A348-N351 PolarHBondContact O-N 3.19Å; N351-A353 PolarHBondContact O-N 3.42Å; N351-Y354 WeakPolarHBondContact O-CB 3.44Å; N351-Y354 WeakPolarHBondContact O-CD2 3.42Å; N351-Y354 PolarHBondContact O-N 3.31Å; N351-Y354 VanDerWaalsContact O-N 3.14Å |
| 352 | L | 92.8 | Very high | 92.4 | Very high | 83 Ų | 83 | 36.7 Ų | 36.7 | 44% | 0.435 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -59 | -29.3 | 172.6 | -178.7 | 62.1 | 0 | 0 | 0 | 111.4 | M224 A348 A349 Y354 L355 S356 | M224-L352 HydrophobicContact SD-CB 4.3Å; M224-L352 HydrophobicContact SD-CD1 3.91Å; A348-L352 WeakPolarHBondContact O-CB 3.21Å; A348-L352 PolarHBondContact O-N 3.49Å; A349-L352 PolarHBondContact O-N 2.98Å; L352-Y354 PolarHBondContact O-N 3.14Å; L352-L355 HydrophobicContact CD1-CB 4.5Å; L352-L355 HydrophobicContact CD1-CD1 4.17Å; L352-L355 WeakPolarHBondContact O-CB 3.46Å; L352-L355 PolarHBondContact O-N 3.21Å; L352-S356 PolarHBondContact O-N 3.5Å; L352-S356 VanDerWaalsContact O-N 3.15Å |
| 353 | A | 91 | Very high | 92.2 | Very high | 4 Ų | 4 | 38 Ų | 38 | 3% | 0.033 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -65.3 | -17 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | A349 L350 N351 S356 S357 F407 | A349-A353 PolarHBondContact O-N 3.45Å; L350-A353 WeakPolarHBondContact O-CB 3.36Å; L350-A353 PolarHBondContact O-N 3.32Å; N351-A353 PolarHBondContact O-N 3.42Å; A353-S356 VanDerWaalsContact CA-OG 3.26Å; A353-S356 WeakPolarHBondContact CA-OG 3.46Å; A353-S356 PolarHBondContact O-OG 3.4Å; A353-S357 WeakPolarHBondContact O-CB 3.27Å; A353-S357 PolarHBondContact O-N 3.35Å; A353-S357 PolarHBondContact O-OG 2.77Å; A353-F407 HydrophobicContact CB-CD1 3.66Å; A353-F407 HydrophobicContact CB-CE1 3.49Å; A353-F407 VanDerWaalsContact CB-CE1 3.49Å |
| 354 | Y | 89.4 | Confident | 92 | Very high | 28 Ų | 28 | 39.3 Ų | 39.3 | 11% | 0.11 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -63.5 | -44.7 | 166.6 | -78 | -96.3 | 0 | 0 | 0 | 111.5 | N351 L352 L358 F407 M408 | N351-Y354 WeakPolarHBondContact O-CB 3.44Å; N351-Y354 WeakPolarHBondContact O-CD2 3.42Å; N351-Y354 PolarHBondContact O-N 3.31Å; N351-Y354 VanDerWaalsContact O-N 3.14Å; L352-Y354 PolarHBondContact O-N 3.14Å; Y354-L358 WeakPolarHBondContact O-CB 3.29Å; Y354-L358 PolarHBondContact O-N 3.18Å; Y354-L358 VanDerWaalsContact O-N 3.09Å; Y354-F407 HydrophobicContact CE2-CZ 4.39Å; Y354-M408 HydrophobicContact CD1-CG 4.14Å; Y354-M408 HydrophobicContact CE1-CG 3.97Å; Y354-M408 HydrophobicContact CE1-SD 3.99Å; Y354-M408 HydrophobicContact CE2-CG 4.5Å; Y354-M408 HydrophobicContact CG-CG 4.47Å |
| 355 | L | 90.8 | Very high | 91.6 | Very high | 48 Ų | 48 | 43.5 Ų | 43.5 | 25% | 0.251 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -69.4 | -45.8 | 178.9 | -71.9 | 109 | 0 | 0 | 0 | 111.8 | I221 L352 S357 L358 L359 | I221-L355 HydrophobicContact CD1-CD2 4.05Å; I221-L355 HydrophobicContact CG1-CD1 3.92Å; I221-L355 HydrophobicContact CG1-CD2 3.73Å; I221-L355 HydrophobicContact CG1-CG 4.34Å; L352-L355 HydrophobicContact CD1-CB 4.5Å; L352-L355 HydrophobicContact CD1-CD1 4.17Å; L352-L355 WeakPolarHBondContact O-CB 3.46Å; L352-L355 PolarHBondContact O-N 3.21Å; L355-S357 VanDerWaalsContact C-N 3.31Å; L355-S357 PolarHBondContact O-N 3.27Å; L355-L358 PolarHBondContact O-N 3.47Å; L355-L359 PolarHBondContact O-N 2.96Å |
| 356 | S | 92.3 | Very high | 91.3 | Very high | 33 Ų | 33 | 47.6 Ų | 47.6 | 23% | 0.231 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -66.9 | -34.5 | 179.4 | 59.9 | 0 | 0 | 0 | 0 | 111.9 | L352 A353 G360 F405 | L352-S356 PolarHBondContact O-N 3.5Å; L352-S356 VanDerWaalsContact O-N 3.15Å; A353-S356 VanDerWaalsContact CA-OG 3.26Å; A353-S356 WeakPolarHBondContact CA-OG 3.46Å; A353-S356 PolarHBondContact O-OG 3.4Å; S356-G360 WeakPolarHBondContact O-CA 3.45Å; S356-G360 PolarHBondContact O-N 2.96Å; S356-F405 PolarHBondContact OG-O 2.89Å |
| 357 | S | 91.3 | Very high | 91.1 | Very high | 4 Ų | 4 | 53 Ų | 53 | 3% | 0.028 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -64.4 | -41.8 | 173.1 | -65.6 | 0 | 0 | 0 | 0 | 111.8 | A353 L355 G360 L361 F405 L406 M408 | A353-S357 WeakPolarHBondContact O-CB 3.27Å; A353-S357 PolarHBondContact O-N 3.35Å; A353-S357 PolarHBondContact O-OG 2.77Å; L355-S357 VanDerWaalsContact C-N 3.31Å; L355-S357 PolarHBondContact O-N 3.27Å; S357-G360 PolarHBondContact O-N 2.72Å; S357-L361 WeakPolarHBondContact O-CB 3.46Å; S357-L361 PolarHBondContact O-N 3.39Å; S357-F405 PolarHBondContact N-O 3.09Å; S357-F405 PolarHBondContact OG-O 3.45Å; S357-L406 VanDerWaalsContact OG-C 3.25Å; S357-L406 WeakPolarHBondContact OG-CA 3.47Å; S357-M408 PolarHBondContact OG-N 3.43Å |
| 358 | L | 89 | Confident | 90.7 | Very high | 56 Ų | 56 | 55.9 Ų | 55.9 | 29% | 0.293 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -66.4 | -44.9 | 178.4 | -173.4 | 133 | 0 | 0 | 0 | 112.3 | A213 E216 Y354 L355 K362 | A213-L358 HydrophobicContact CB-CD1 3.7Å; A213-L358 HydrophobicContact CB-CD2 4.29Å; A213-L358 HydrophobicContact CB-CG 4.46Å; E216-L358 HydrophobicContact CB-CD1 3.69Å; E216-L358 HydrophobicContact CG-CD1 4.34Å; Y354-L358 WeakPolarHBondContact O-CB 3.29Å; Y354-L358 PolarHBondContact O-N 3.18Å; Y354-L358 VanDerWaalsContact O-N 3.09Å; L355-L358 PolarHBondContact O-N 3.47Å; L358-K362 PolarHBondContact O-N 2.94Å |
| 359 | L | 90.2 | Very high | 90.3 | Very high | 112 Ų | 112 | 60.5 Ų | 60.5 | 59% | 0.586 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -65 | -45.7 | 175.5 | -178.4 | 59.6 | 0 | 0 | 0 | 110.9 | L355 L361 K362 V363 | L355-L359 PolarHBondContact O-N 2.96Å; L359-L361 PolarHBondContact O-N 3.45Å; L359-K362 PolarHBondContact O-N 3.17Å; L359-V363 HydrophobicContact CD1-CG2 4.34Å; L359-V363 WeakPolarHBondContact O-CG2 3.43Å; L359-V363 PolarHBondContact O-N 3.49Å |
| 360 | G | 88.8 | Confident | 89.9 | Confident | 13 Ų | 13 | 60.9 Ų | 60.9 | 13% | 0.134 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -58.7 | -46.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | S356 S357 K362 V363 M364 | S356-G360 WeakPolarHBondContact O-CA 3.45Å; S356-G360 PolarHBondContact O-N 2.96Å; S357-G360 PolarHBondContact O-N 2.72Å; G360-K362 PolarHBondContact O-N 3.2Å; G360-V363 PolarHBondContact O-N 2.82Å; G360-M364 VanDerWaalsContact C-CE 3.41Å; G360-M364 VanDerWaalsContact O-CB 3.31Å; G360-M364 WeakPolarHBondContact O-CB 3.4Å; G360-M364 VanDerWaalsContact O-CE 3.27Å; G360-M364 WeakPolarHBondContact O-CE 3.12Å; G360-M364 VanDerWaalsContact O-CG 3.25Å; G360-M364 WeakPolarHBondContact O-CG 3.31Å; G360-M364 PolarHBondContact O-N 3.32Å |
| 361 | L | 88 | Confident | 89.7 | Confident | 26 Ų | 26 | 60.3 Ų | 60.3 | 14% | 0.136 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -54 | -51.4 | 174.5 | 177.3 | 63.6 | 0 | 0 | 0 | 111.1 | S357 L359 V363 M364 Q365 V373 P412 I413 | S357-L361 WeakPolarHBondContact O-CB 3.46Å; S357-L361 PolarHBondContact O-N 3.39Å; L359-L361 PolarHBondContact O-N 3.45Å; L361-V363 VanDerWaalsContact C-N 3.35Å; L361-V363 PolarHBondContact O-N 3.31Å; L361-M364 PolarHBondContact O-N 3.34Å; L361-Q365 HydrophobicContact CD1-CG 4.03Å; L361-Q365 VanDerWaalsContact O-CB 3.31Å; L361-Q365 WeakPolarHBondContact O-CB 3.34Å; L361-Q365 VanDerWaalsContact O-CG 3.26Å; L361-Q365 WeakPolarHBondContact O-CG 3.21Å; L361-Q365 PolarHBondContact O-N 2.69Å; L361-V373 HydrophobicContact CD1-CG1 3.74Å; L361-P412 HydrophobicContact CD2-CB 4.42Å; L361-P412 HydrophobicContact CD2-CG 3.87Å; L361-I413 HydrophobicContact CD1-CD1 3.69Å; L361-I413 HydrophobicContact CD1-CG1 3.78Å |
| 362 | K | 87.8 | Confident | 89.6 | Confident | 136 Ų | 136 | 65.1 Ų | 65.1 | 59% | 0.591 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -63.6 | -38 | -178.9 | -174.5 | 173.6 | -176.5 | 175.2 | 0 | 113 | L358 L359 G360 | L358-K362 PolarHBondContact O-N 2.94Å; L359-K362 PolarHBondContact O-N 3.17Å; G360-K362 PolarHBondContact O-N 3.2Å |
| 363 | V | 91.1 | Very high | 89.6 | Confident | 77 Ų | 77 | 61.2 Ų | 61.2 | 47% | 0.467 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -70.6 | -48.8 | 177.9 | 171.8 | 0 | 0 | 0 | 0 | 110.4 | L359 G360 L361 Q365 R366 | L359-V363 HydrophobicContact CD1-CG2 4.34Å; L359-V363 WeakPolarHBondContact O-CG2 3.43Å; L359-V363 PolarHBondContact O-N 3.49Å; G360-V363 PolarHBondContact O-N 2.82Å; L361-V363 VanDerWaalsContact C-N 3.35Å; L361-V363 PolarHBondContact O-N 3.31Å; V363-Q365 PolarHBondContact O-N 3.2Å; V363-R366 WeakPolarHBondContact O-CB 3.31Å; V363-R366 PolarHBondContact O-N 3.43Å; V363-R366 VanDerWaalsContact O-N 3.17Å |
| 364 | M | 90.1 | Very high | 89.6 | Confident | 29 Ų | 29 | 61.1 Ų | 61.1 | 14% | 0.143 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -65.6 | -36.6 | -178 | -70.6 | -175.6 | -74.1 | 0 | 0 | 112.5 | G360 L361 R366 C367 L368 V373 V376 L406 | G360-M364 VanDerWaalsContact C-CE 3.41Å; G360-M364 VanDerWaalsContact O-CB 3.31Å; G360-M364 WeakPolarHBondContact O-CB 3.4Å; G360-M364 VanDerWaalsContact O-CE 3.27Å; G360-M364 WeakPolarHBondContact O-CE 3.12Å; G360-M364 VanDerWaalsContact O-CG 3.25Å; G360-M364 WeakPolarHBondContact O-CG 3.31Å; G360-M364 PolarHBondContact O-N 3.32Å; L361-M364 PolarHBondContact O-N 3.34Å; M364-R366 PolarHBondContact O-N 3.25Å; M364-R366 VanDerWaalsContact O-N 3.09Å; M364-C367 PolarHBondContact O-N 3.49Å; M364-L368 HydrophobicContact CB-CD1 4.39Å; M364-L368 WeakPolarHBondContact O-CB 3.26Å; M364-L368 PolarHBondContact O-N 3.42Å; M364-V373 HydrophobicContact CB-CG1 3.87Å; M364-V373 HydrophobicContact CB-CG2 3.88Å; M364-V373 HydrophobicContact CE-CG1 3.6Å; M364-V373 HydrophobicContact SD-CG1 4.09Å; M364-V376 HydrophobicContact SD-CB 4.21Å; M364-V376 HydrophobicContact SD-CG1 3.75Å; M364-L406 HydrophobicContact CE-CD1 3.71Å; M364-L406 HydrophobicContact CE-CD2 3.89Å; M364-L406 HydrophobicContact CE-CG 4.36Å; M364-L406 HydrophobicContact SD-CD1 4.05Å |
| 365 | Q | 88.1 | Confident | 89.9 | Confident | 90 Ų | 90 | 61 Ų | 61 | 42% | 0.421 | 31% | 0.305 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.8 | -11.7 | 176.2 | -79.1 | -178.9 | -36.7 | 0 | 0 | 114.2 | L361 V363 C367 D370 V373 | L361-Q365 HydrophobicContact CD1-CG 4.03Å; L361-Q365 VanDerWaalsContact O-CB 3.31Å; L361-Q365 WeakPolarHBondContact O-CB 3.34Å; L361-Q365 VanDerWaalsContact O-CG 3.26Å; L361-Q365 WeakPolarHBondContact O-CG 3.21Å; L361-Q365 PolarHBondContact O-N 2.69Å; V363-Q365 PolarHBondContact O-N 3.2Å; Q365-C367 VanDerWaalsContact C-N 3.33Å; Q365-D370 PolarHBondContact NE2-OD1 2.92Å; Q365-V373 HydrophobicContact CG-CG2 4.26Å |
| 366 | R | 89.4 | Confident | 90.1 | Very high | 194 Ų | 194 | 61.5 Ų | 61.5 | 73% | 0.732 | 31% | 0.31 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74 | -26.6 | 170.4 | -65.8 | -175.5 | 175.6 | 159.8 | -3.2 | 112.9 | V363 M364 | V363-R366 WeakPolarHBondContact O-CB 3.31Å; V363-R366 PolarHBondContact O-N 3.43Å; V363-R366 VanDerWaalsContact O-N 3.17Å; M364-R366 PolarHBondContact O-N 3.25Å; M364-R366 VanDerWaalsContact O-N 3.09Å |
| 367 | C | 90.8 | Very high | 90.2 | Very high | 115 Ų | 115 | 59.9 Ų | 59.9 | 78% | 0.777 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -120.4 | -21.5 | -170.6 | -54.8 | 0 | 0 | 0 | 0 | 113 | M364 Q365 | M364-C367 PolarHBondContact O-N 3.49Å; Q365-C367 VanDerWaalsContact C-N 3.33Å |
| 368 | L | 88.3 | Confident | 90.4 | Very high | 73 Ų | 73 | 59.7 Ų | 59.7 | 38% | 0.382 | 30% | 0.298 | S | S | . | . | S | Bend | trans | -125.4 | 145.7 | -172 | -62.9 | 176.2 | 0 | 0 | 0 | 111.1 | M364 W372 V373 V376 | M364-L368 HydrophobicContact CB-CD1 4.39Å; M364-L368 WeakPolarHBondContact O-CB 3.26Å; M364-L368 PolarHBondContact O-N 3.42Å; L368-W372 HydrophobicContact CB-CB 4.3Å; L368-V373 HydrophobicContact CB-CG2 3.71Å; L368-V376 HydrophobicContact CD1-CG2 4.5Å |
| 369 | Q | 87.5 | Confident | 90.8 | Very high | 104 Ų | 104 | 61.1 Ų | 61.1 | 49% | 0.486 | 31% | 0.309 | S | S | . | . | trans | -69.2 | 151.2 | 170.4 | -58.9 | -179.4 | -11.5 | 0 | 0 | 110.8 | S371 W372 V373 | Q369-S371 PolarHBondContact O-N 2.87Å; Q369-W372 PolarHBondContact O-N 3.5Å; Q369-V373 PolarHBondContact O-N 2.96Å | ||
| 370 | D | 86.1 | Confident | 91.1 | Very high | 35 Ų | 35 | 56.3 Ų | 56.3 | 19% | 0.187 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -43.6 | -45 | -177.9 | -74.7 | -16.4 | 0 | 0 | 0 | 113.5 | Q365 W372 V373 A374 I413 K420 | Q365-D370 PolarHBondContact NE2-OD1 2.92Å; D370-W372 PolarHBondContact O-N 3.28Å; D370-V373 PolarHBondContact O-N 2.98Å; D370-A374 PolarHBondContact O-N 3.41Å; D370-I413 HydrophobicContact CB-CG2 4.12Å; D370-K420 IonicContact OD2-NZ 3.79Å; D370-K420 PolarHBondContact OD2-NZ 2.85Å; D370-K420 VanDerWaalsContact OD2-NZ 3.16Å |
| 371 | S | 88.1 | Confident | 91.5 | Very high | 2 Ų | 2 | 55.9 Ų | 55.9 | 1% | 0.014 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -65.1 | -39.4 | -177.5 | -46.4 | 0 | 0 | 0 | 0 | 112.9 | Q369 A374 L375 K417 Q483 | Q369-S371 PolarHBondContact O-N 2.87Å; S371-A374 PolarHBondContact O-N 3.19Å; S371-L375 WeakPolarHBondContact O-CG 3.37Å; S371-L375 PolarHBondContact O-N 3.39Å; S371-L375 VanDerWaalsContact O-N 3.1Å; S371-K417 WeakPolarHBondContact OG-CE 3.39Å; S371-K417 PolarHBondContact OG-NZ 3.07Å; S371-Q483 PolarHBondContact OG-OE1 3.04Å |
| 372 | W | 91.1 | Very high | 91.9 | Very high | 106 Ų | 106 | 55.7 Ų | 55.7 | 40% | 0.402 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -68.8 | -37.1 | 176.9 | -70.7 | 110.7 | 0 | 0 | 0 | 111.5 | L368 Q369 D370 A374 L375 V376 | L368-W372 HydrophobicContact CB-CB 4.3Å; Q369-W372 PolarHBondContact O-N 3.5Å; D370-W372 PolarHBondContact O-N 3.28Å; W372-A374 VanDerWaalsContact C-N 3.3Å; W372-A374 PolarHBondContact O-N 3.09Å; W372-L375 HydrophobicContact CE3-CD1 3.78Å; W372-L375 HydrophobicContact CZ3-CD1 3.96Å; W372-L375 PolarHBondContact O-N 3.46Å; W372-V376 WeakPolarHBondContact O-CG2 3.4Å; W372-V376 PolarHBondContact O-N 3.39Å |
| 373 | V | 92.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.7 | -40 | 174.7 | -171.8 | 0 | 0 | 0 | 0 | 111.1 | L361 M364 Q365 L368 Q369 D370 L375 V376 G377 I413 | L361-V373 HydrophobicContact CD1-CG1 3.74Å; M364-V373 HydrophobicContact CB-CG1 3.87Å; M364-V373 HydrophobicContact CB-CG2 3.88Å; M364-V373 HydrophobicContact CE-CG1 3.6Å; M364-V373 HydrophobicContact SD-CG1 4.09Å; Q365-V373 HydrophobicContact CG-CG2 4.26Å; L368-V373 HydrophobicContact CB-CG2 3.71Å; Q369-V373 PolarHBondContact O-N 2.96Å; D370-V373 PolarHBondContact O-N 2.98Å; V373-L375 VanDerWaalsContact C-N 3.35Å; V373-L375 PolarHBondContact O-N 2.73Å; V373-V376 PolarHBondContact O-N 3.43Å; V373-G377 PolarHBondContact O-N 2.9Å; V373-I413 HydrophobicContact CB-CD1 3.74Å; V373-I413 HydrophobicContact CG1-CD1 3.76Å |
| 374 | A | 92.2 | Very high | 92.7 | Very high | 2 Ų | 2 | 48.3 Ų | 48.3 | 2% | 0.017 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -63.6 | -39.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | D370 S371 W372 G377 L378 S410 I413 I479 | D370-A374 PolarHBondContact O-N 3.41Å; S371-A374 PolarHBondContact O-N 3.19Å; W372-A374 VanDerWaalsContact C-N 3.3Å; W372-A374 PolarHBondContact O-N 3.09Å; A374-G377 PolarHBondContact O-N 3.41Å; A374-L378 WeakPolarHBondContact O-CG 3.43Å; A374-L378 PolarHBondContact O-N 3.34Å; A374-S410 PolarHBondContact O-OG 3.49Å; A374-I413 HydrophobicContact CB-CB 4.18Å; A374-I413 HydrophobicContact CB-CD1 3.82Å; A374-I413 HydrophobicContact CB-CG2 3.87Å; A374-I413 VanDerWaalsContact N-CD1 3.33Å; A374-I479 HydrophobicContact CB-CD1 4.36Å |
| 375 | L | 94.5 | Very high | 93 | Very high | 25 Ų | 25 | 46.9 Ų | 46.9 | 13% | 0.131 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -65.1 | -42.9 | 176.1 | -70.8 | 173 | 0 | 0 | 0 | 112 | S371 W372 V373 G377 L378 V379 A476 I479 | S371-L375 WeakPolarHBondContact O-CG 3.37Å; S371-L375 PolarHBondContact O-N 3.39Å; S371-L375 VanDerWaalsContact O-N 3.1Å; W372-L375 HydrophobicContact CE3-CD1 3.78Å; W372-L375 HydrophobicContact CZ3-CD1 3.96Å; W372-L375 PolarHBondContact O-N 3.46Å; V373-L375 VanDerWaalsContact C-N 3.35Å; V373-L375 PolarHBondContact O-N 2.73Å; L375-G377 VanDerWaalsContact C-N 3.33Å; L375-G377 PolarHBondContact O-N 2.97Å; L375-L378 PolarHBondContact O-N 3.12Å; L375-V379 WeakPolarHBondContact O-CG2 3.47Å; L375-V379 PolarHBondContact O-N 2.86Å; L375-A476 HydrophobicContact CD2-CB 4.28Å; L375-A476 VanDerWaalsContact CD2-O 3.25Å; L375-A476 WeakPolarHBondContact CD2-O 3.44Å; L375-I479 HydrophobicContact CD2-CB 4.16Å; L375-I479 HydrophobicContact CD2-CG2 4.13Å; L375-I479 HydrophobicContact CG-CG2 4.09Å |
| 376 | V | 95.1 | Very high | 93.5 | Very high | 59 Ų | 59 | 45.6 Ų | 45.6 | 36% | 0.358 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -61.2 | -43.1 | 175.3 | 173.2 | 0 | 0 | 0 | 0 | 111 | M364 L368 W372 V373 L378 V379 S380 L406 | M364-V376 HydrophobicContact SD-CB 4.21Å; M364-V376 HydrophobicContact SD-CG1 3.75Å; L368-V376 HydrophobicContact CD1-CG2 4.5Å; W372-V376 WeakPolarHBondContact O-CG2 3.4Å; W372-V376 PolarHBondContact O-N 3.39Å; V373-V376 PolarHBondContact O-N 3.43Å; V376-L378 PolarHBondContact O-N 3.17Å; V376-V379 PolarHBondContact O-N 2.98Å; V376-S380 WeakPolarHBondContact O-CB 3.43Å; V376-S380 PolarHBondContact O-N 3.09Å; V376-L406 HydrophobicContact CG1-CD1 3.96Å |
| 377 | G | 94.7 | Very high | 93.8 | Very high | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60 | -42.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | V373 A374 L375 S380 N381 | V373-G377 PolarHBondContact O-N 2.9Å; A374-G377 PolarHBondContact O-N 3.41Å; L375-G377 VanDerWaalsContact C-N 3.33Å; L375-G377 PolarHBondContact O-N 2.97Å; G377-S380 PolarHBondContact O-N 2.95Å; G377-N381 PolarHBondContact O-N 2.98Å |
| 378 | L | 96.1 | Very high | 94.1 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -65.8 | -42.6 | 176.3 | -72.7 | 173.2 | 0 | 0 | 0 | 112.3 | V316 A374 L375 V376 N381 I382 S410 L472 P475 A476 I479 | V316-L378 HydrophobicContact CG2-CD2 3.77Å; A374-L378 WeakPolarHBondContact O-CG 3.43Å; A374-L378 PolarHBondContact O-N 3.34Å; L375-L378 PolarHBondContact O-N 3.12Å; V376-L378 PolarHBondContact O-N 3.17Å; L378-N381 PolarHBondContact O-N 3.48Å; L378-I382 WeakPolarHBondContact O-CB 3.41Å; L378-I382 WeakPolarHBondContact O-CD1 3.37Å; L378-I382 WeakPolarHBondContact O-CG1 3.38Å; L378-I382 PolarHBondContact O-N 3.22Å; L378-S410 PolarHBondContact N-OG 2.95Å; L378-L472 HydrophobicContact CD2-CD2 4.3Å; L378-P475 HydrophobicContact CD1-CB 4.36Å; L378-P475 HydrophobicContact CD2-CG 4.49Å; L378-A476 HydrophobicContact CB-CB 4.43Å; L378-A476 HydrophobicContact CD1-CB 3.95Å; L378-I479 HydrophobicContact CD1-CD1 3.88Å |
| 379 | V | 96.7 | Very high | 94.4 | Very high | 86 Ų | 86 | 28.9 Ų | 28.9 | 52% | 0.521 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -63.1 | -43.2 | 176.9 | 170.3 | 0 | 0 | 0 | 0 | 111 | L375 V376 N381 I382 T383 | L375-V379 WeakPolarHBondContact O-CG2 3.47Å; L375-V379 PolarHBondContact O-N 2.86Å; V376-V379 PolarHBondContact O-N 2.98Å; V379-N381 VanDerWaalsContact C-N 3.33Å; V379-N381 PolarHBondContact O-N 3.22Å; V379-I382 PolarHBondContact O-N 3.1Å; V379-T383 WeakPolarHBondContact O-CB 3.27Å; V379-T383 PolarHBondContact O-N 2.97Å; V379-T383 PolarHBondContact O-OG1 2.82Å |
| 380 | S | 96.7 | Very high | 94.7 | Very high | 11 Ų | 11 | 27.2 Ų | 27.2 | 8% | 0.077 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -56.5 | -47.3 | 173.7 | 164.9 | 0 | 0 | 0 | 0 | 111.3 | V376 G377 T383 G384 L403 L406 | V376-S380 WeakPolarHBondContact O-CB 3.43Å; V376-S380 PolarHBondContact O-N 3.09Å; G377-S380 PolarHBondContact O-N 2.95Å; S380-T383 PolarHBondContact O-N 3.32Å; S380-G384 PolarHBondContact O-N 3.45Å; S380-G384 VanDerWaalsContact O-N 3.09Å; S380-L403 CarbonylContact C-O 3.6Å; S380-L403 WeakPolarHBondContact CB-O 3.45Å; S380-L403 PolarHBondContact OG-O 3.42Å; S380-L406 PolarHBondContact OG-N 3.02Å |
| 381 | N | 96.3 | Very high | 95 | Very high | 3 Ų | 3 | 25.6 Ų | 25.6 | 2% | 0.016 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -65.3 | -48 | 178.6 | -164.7 | 10.7 | 0 | 0 | 0 | 112.9 | H320 G377 L378 V379 T383 G384 L385 F407 L472 | H320-N381 PolarHBondContact CD2-ND2 3.24Å; H320-N381 VanDerWaalsContact CD2-ND2 3.34Å; H320-N381 PolarHBondContact NE2-ND2 3.35Å; G377-N381 PolarHBondContact O-N 2.98Å; L378-N381 PolarHBondContact O-N 3.48Å; V379-N381 VanDerWaalsContact C-N 3.33Å; V379-N381 PolarHBondContact O-N 3.22Å; N381-T383 VanDerWaalsContact C-N 3.31Å; N381-T383 PolarHBondContact O-N 3.41Å; N381-G384 PolarHBondContact O-N 3.49Å; N381-L385 WeakPolarHBondContact O-CB 3.25Å; N381-L385 VanDerWaalsContact O-CG 3.31Å; N381-L385 WeakPolarHBondContact O-CG 3.38Å; N381-L385 PolarHBondContact O-N 3.34Å; N381-F407 HydrophobicContact CB-CB 3.89Å; N381-L472 HydrophobicContact CB-CD1 4.17Å; N381-L472 WeakPolarHBondContact ND2-CD1 3.44Å |
| 382 | I | 97.8 | Very high | 95.1 | Very high | 23 Ų | 23 | 31.3 Ų | 31.3 | 12% | 0.118 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -57.5 | -46.2 | 177.3 | -71.6 | 162.7 | 0 | 0 | 0 | 110.3 | L378 V379 L385 V386 A469 L472 L473 | L378-I382 WeakPolarHBondContact O-CB 3.41Å; L378-I382 WeakPolarHBondContact O-CD1 3.37Å; L378-I382 WeakPolarHBondContact O-CG1 3.38Å; L378-I382 PolarHBondContact O-N 3.22Å; V379-I382 PolarHBondContact O-N 3.1Å; I382-L385 PolarHBondContact O-N 3.38Å; I382-V386 HydrophobicContact CG2-CG2 4.5Å; I382-V386 VanDerWaalsContact O-CG2 3.3Å; I382-V386 WeakPolarHBondContact O-CG2 3.48Å; I382-V386 PolarHBondContact O-N 3.44Å; I382-A469 HydrophobicContact CG2-CB 4.26Å; I382-L472 HydrophobicContact CD1-CB 4.02Å; I382-L472 HydrophobicContact CG1-CB 3.66Å; I382-L472 HydrophobicContact CG1-CD1 4.25Å; I382-L473 HydrophobicContact CD1-CD2 3.94Å; I382-L473 HydrophobicContact CD1-CG 4.47Å |
| 383 | T | 97.5 | Very high | 95.1 | Very high | 57 Ų | 57 | 29.6 Ų | 29.6 | 35% | 0.35 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -63.3 | -45.6 | -178.3 | -51.7 | 0 | 0 | 0 | 0 | 111 | V379 S380 N381 V386 V387 L403 | V379-T383 WeakPolarHBondContact O-CB 3.27Å; V379-T383 PolarHBondContact O-N 2.97Å; V379-T383 PolarHBondContact O-OG1 2.82Å; S380-T383 PolarHBondContact O-N 3.32Å; N381-T383 VanDerWaalsContact C-N 3.31Å; N381-T383 PolarHBondContact O-N 3.41Å; T383-V386 PolarHBondContact O-N 3.03Å; T383-V387 WeakPolarHBondContact O-CG2 3.26Å; T383-V387 PolarHBondContact O-N 2.95Å; T383-L403 HydrophobicContact CG2-CD1 4.09Å; T383-L403 HydrophobicContact CG2-CD2 4.49Å |
| 384 | G | 96.9 | Very high | 95.1 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -67.7 | -37.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | S380 N381 V386 V387 F388 C404 | S380-G384 PolarHBondContact O-N 3.45Å; S380-G384 VanDerWaalsContact O-N 3.09Å; N381-G384 PolarHBondContact O-N 3.49Å; G384-V386 PolarHBondContact O-N 3.2Å; G384-V387 PolarHBondContact O-N 3.36Å; G384-V387 VanDerWaalsContact O-N 3.17Å; G384-F388 WeakPolarHBondContact O-CD2 3.22Å; G384-F388 VanDerWaalsContact O-CG 3.26Å; G384-F388 WeakPolarHBondContact O-CG 3.35Å; G384-F388 PolarHBondContact O-N 2.74Å; G384-C404 WeakPolarHBondContact CA-SG 3.3Å |
| 385 | L | 97.2 | Very high | 95.2 | Very high | 0 Ų | 0 | 39.3 Ų | 39.3 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62 | -39.7 | 172.9 | -73.6 | 169.6 | 0 | 0 | 0 | 113 | V319 T323 N381 I382 V387 F388 S389 F465 A468 A469 L472 | V319-L385 HydrophobicContact CG1-CD1 4.15Å; T323-L385 HydrophobicContact CG2-CD2 3.96Å; N381-L385 WeakPolarHBondContact O-CB 3.25Å; N381-L385 VanDerWaalsContact O-CG 3.31Å; N381-L385 WeakPolarHBondContact O-CG 3.38Å; N381-L385 PolarHBondContact O-N 3.34Å; I382-L385 PolarHBondContact O-N 3.38Å; L385-V387 VanDerWaalsContact C-N 3.35Å; L385-F388 HydrophobicContact CD2-CD2 4.37Å; L385-F388 PolarHBondContact O-N 3.08Å; L385-S389 PolarHBondContact O-N 3.42Å; L385-F465 HydrophobicContact CD2-CB 4.4Å; L385-F465 HydrophobicContact CD2-CD1 4.03Å; L385-F465 WeakPolarHBondContact O-CB 3.44Å; L385-A468 HydrophobicContact CD1-CB 3.9Å; L385-A468 HydrophobicContact CD2-CB 4.22Å; L385-A469 HydrophobicContact CB-CB 3.97Å; L385-L472 HydrophobicContact CD1-CD1 3.56Å |
| 386 | V | 97.8 | Very high | 95.2 | Very high | 63 Ų | 63 | 40.8 Ų | 40.8 | 38% | 0.382 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -62.4 | -44.3 | 172.7 | 169.8 | 0 | 0 | 0 | 0 | 110.2 | I382 T383 G384 F388 S389 L466 A469 | I382-V386 HydrophobicContact CG2-CG2 4.5Å; I382-V386 VanDerWaalsContact O-CG2 3.3Å; I382-V386 WeakPolarHBondContact O-CG2 3.48Å; I382-V386 PolarHBondContact O-N 3.44Å; T383-V386 PolarHBondContact O-N 3.03Å; G384-V386 PolarHBondContact O-N 3.2Å; V386-F388 PolarHBondContact O-N 3.5Å; V386-S389 WeakPolarHBondContact O-CB 3.38Å; V386-S389 PolarHBondContact O-N 2.9Å; V386-S389 PolarHBondContact O-OG 2.95Å; V386-L466 HydrophobicContact CG2-CD1 4.3Å; V386-A469 HydrophobicContact CG2-CB 3.89Å |
| 387 | V | 97.1 | Very high | 95.1 | Very high | 24 Ų | 24 | 38 Ų | 38 | 15% | 0.145 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.1 | -42.3 | 176.7 | 171.5 | 0 | 0 | 0 | 0 | 111.9 | T383 G384 L385 S389 V390 A391 L396 L403 | T383-V387 WeakPolarHBondContact O-CG2 3.26Å; T383-V387 PolarHBondContact O-N 2.95Å; G384-V387 PolarHBondContact O-N 3.36Å; G384-V387 VanDerWaalsContact O-N 3.17Å; L385-V387 VanDerWaalsContact C-N 3.35Å; V387-S389 VanDerWaalsContact C-N 3.27Å; V387-S389 PolarHBondContact O-N 3.01Å; V387-V390 WeakPolarHBondContact O-CG2 3.34Å; V387-V390 PolarHBondContact O-N 3.27Å; V387-A391 PolarHBondContact O-N 3.24Å; V387-A391 VanDerWaalsContact O-N 3.13Å; V387-L396 HydrophobicContact CG1-CD1 3.69Å; V387-L396 HydrophobicContact CG1-CG 3.94Å; V387-L396 VanDerWaalsContact CG1-O 3.3Å; V387-L396 WeakPolarHBondContact CG1-O 3.44Å; V387-L403 HydrophobicContact CB-CD1 4.45Å; V387-L403 HydrophobicContact CG2-CD1 3.71Å |
| 388 | F | 95.8 | Very high | 95.2 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -60.3 | -36 | 174.4 | -65.8 | -44.8 | 0 | 0 | 0 | 112.6 | Y327 Y330 G384 L385 V386 V390 A391 M397 Y401 F465 | Y327-F388 HydrophobicContact CE1-CD1 4.4Å; Y327-F388 AromaticContact CE1-CD2 3.64Å; Y327-F388 HydrophobicContact CE1-CD2 3.64Å; Y327-F388 HydrophobicContact CE1-CE1 4.31Å; Y327-F388 AromaticContact CE1-CE2 3.6Å; Y327-F388 HydrophobicContact CE1-CE2 3.6Å; Y327-F388 HydrophobicContact CE1-CG 4.07Å; Y327-F388 AromaticContact CE1-CZ 3.94Å; Y327-F388 HydrophobicContact CE1-CZ 3.94Å; Y327-F388 AromaticContact CZ-CE2 3.83Å; Y327-F388 VanDerWaalsContact OH-CE2 3.29Å; Y327-F388 WeakPolarHBondContact OH-CE2 3.46Å; Y330-F388 PolarHBondContact OH-O 3.3Å; G384-F388 WeakPolarHBondContact O-CD2 3.22Å; G384-F388 VanDerWaalsContact O-CG 3.26Å; G384-F388 WeakPolarHBondContact O-CG 3.35Å; G384-F388 PolarHBondContact O-N 2.74Å; L385-F388 HydrophobicContact CD2-CD2 4.37Å; L385-F388 PolarHBondContact O-N 3.08Å; V386-F388 PolarHBondContact O-N 3.5Å; F388-V390 PolarHBondContact O-N 3.35Å; F388-A391 WeakPolarHBondContact O-CB 3.4Å; F388-A391 PolarHBondContact O-N 3.21Å; F388-M397 HydrophobicContact CD1-SD 3.25Å; F388-M397 WeakPolarHBondContact CD1-SD 3.33Å; F388-M397 HydrophobicContact CE1-CG 4.38Å; F388-M397 VanDerWaalsContact CE1-O 3.29Å; F388-M397 WeakPolarHBondContact CE1-O 3.43Å; F388-M397 HydrophobicContact CE1-SD 3.45Å; F388-M397 WeakPolarHBondContact CE1-SD 3.39Å; F388-M397 HydrophobicContact CG-SD 4.33Å; F388-Y401 AromaticContact CE1-CD1 3.86Å; F388-Y401 HydrophobicContact CE1-CD1 3.86Å; F388-Y401 AromaticContact CE1-CE1 3.94Å; F388-Y401 HydrophobicContact CE1-CE1 3.94Å; F388-Y401 HydrophobicContact CE1-CG 4.18Å; F388-Y401 AromaticContact CZ-CD1 3.41Å; F388-Y401 HydrophobicContact CZ-CD1 3.41Å; F388-Y401 VanDerWaalsContact CZ-CD1 3.41Å; F388-Y401 AromaticContact CZ-CE1 3.74Å; F388-Y401 HydrophobicContact CZ-CE1 3.74Å; F388-Y401 HydrophobicContact CZ-CG 4.01Å; F388-Y401 VanDerWaalsContact CZ-N 3.3Å; F388-F465 HydrophobicContact CB-CB 4.21Å; F388-F465 HydrophobicContact CB-CD1 4.4Å; F388-F465 HydrophobicContact CB-CD2 4.03Å; F388-F465 HydrophobicContact CB-CG 3.97Å |
| 389 | S | 95.5 | Very high | 95.2 | Very high | 7 Ų | 7 | 45.1 Ų | 45.1 | 5% | 0.049 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.1 | -23.7 | -179.7 | 78.2 | 0 | 0 | 0 | 0 | 114.1 | L385 V386 V387 G462 | L385-S389 PolarHBondContact O-N 3.42Å; V386-S389 WeakPolarHBondContact O-CB 3.38Å; V386-S389 PolarHBondContact O-N 2.9Å; V386-S389 PolarHBondContact O-OG 2.95Å; V387-S389 VanDerWaalsContact C-N 3.27Å; V387-S389 PolarHBondContact O-N 3.01Å; S389-G462 WeakPolarHBondContact CA-O 3.25Å; S389-G462 WeakPolarHBondContact CB-O 3.49Å; S389-G462 WeakPolarHBondContact O-CA 3.3Å |
| 390 | V | 94.4 | Very high | 95.2 | Very high | 69 Ų | 69 | 41 Ų | 41 | 42% | 0.418 | 22% | 0.222 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -115.8 | 12 | 179.2 | -61.8 | 0 | 0 | 0 | 0 | 112.3 | V387 F388 H392 L396 | V387-V390 WeakPolarHBondContact O-CG2 3.34Å; V387-V390 PolarHBondContact O-N 3.27Å; F388-V390 PolarHBondContact O-N 3.35Å; V390-H392 PolarHBondContact O-CD2 3.45Å; V390-H392 PolarHBondContact O-N 3.27Å; V390-L396 HydrophobicContact CG2-CD2 4.39Å; V390-L396 WeakPolarHBondContact O-CD2 3.33Å |
| 391 | A | 92.4 | Very high | 95.1 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 22% | 0.22 | C | C | . | . | trans | -73.1 | 95.4 | -175.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y330 V387 F388 L396 M397 | Y330-A391 HydrophobicContact CE1-CB 4.33Å; Y330-A391 WeakPolarHBondContact CE1-O 3.46Å; Y330-A391 PolarHBondContact OH-O 3.39Å; V387-A391 PolarHBondContact O-N 3.24Å; V387-A391 VanDerWaalsContact O-N 3.13Å; F388-A391 WeakPolarHBondContact O-CB 3.4Å; F388-A391 PolarHBondContact O-N 3.21Å; A391-L396 HydrophobicContact CB-CB 4.44Å; A391-L396 HydrophobicContact CB-CG 4.35Å; A391-M397 HydrophobicContact CB-CB 4.42Å; A391-M397 HydrophobicContact CB-SD 4.49Å | ||
| 392 | H | 88.6 | Confident | 95 | Very high | 122 Ų | 122 | 43 Ų | 43 | 57% | 0.565 | 24% | 0.242 | S | C | * | . | trans | -95.2 | -10.7 | 173.8 | -64 | -69.1 | 0 | 0 | 0 | 113.8 | P335 V390 | P335-H392 HydrophobicContact CG-CB 3.89Å; P335-H392 VanDerWaalsContact CG-O 3.29Å; P335-H392 WeakPolarHBondContact CG-O 3.33Å; V390-H392 PolarHBondContact O-CD2 3.45Å; V390-H392 PolarHBondContact O-N 3.27Å | ||
| 393 | T | 90.9 | Very high | 94.9 | Very high | 71 Ų | 71 | 45 Ų | 45 | 44% | 0.436 | 25% | 0.253 | S | S | . | . | S | Bend | trans | -128.7 | 152.7 | -178.3 | 67.7 | 0 | 0 | 0 | 0 | 111.1 | Q395 L396 M397 | T393-Q395 PolarHBondContact O-N 3.28Å; T393-L396 PolarHBondContact O-N 3.41Å; T393-L396 VanDerWaalsContact O-N 3.13Å; T393-L396 WeakPolarHBondContact OG1-CB 3.44Å; T393-L396 PolarHBondContact OG1-N 3.39Å; T393-M397 PolarHBondContact O-N 3.36Å; T393-M397 VanDerWaalsContact O-N 3.1Å |
| 394 | T | 92.5 | Very high | 94.7 | Very high | 50 Ų | 50 | 42.4 Ų | 42.4 | 31% | 0.307 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -54.7 | -40 | 176.6 | -58.2 | 0 | 0 | 0 | 0 | 111.8 | W338 L342 M397 F398 | W338-T394 HydrophobicContact CZ2-CG2 3.66Å; W338-T394 PolarHBondContact NE1-OG1 3.12Å; L342-T394 HydrophobicContact CD2-CG2 3.86Å; T394-M397 PolarHBondContact O-N 3.27Å; T394-F398 HydrophobicContact CG2-CD2 3.85Å; T394-F398 HydrophobicContact CG2-CE2 3.74Å; T394-F398 VanDerWaalsContact O-CD2 3.27Å; T394-F398 WeakPolarHBondContact O-CD2 3.25Å; T394-F398 PolarHBondContact O-N 3.38Å |
| 395 | Q | 93.8 | Very high | 94.5 | Very high | 156 Ų | 156 | 47.1 Ų | 47.1 | 73% | 0.729 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -62.2 | -46 | 178.7 | -66.4 | 173.8 | -10.5 | 0 | 0 | 111.6 | T393 M397 F398 T399 | T393-Q395 PolarHBondContact O-N 3.28Å; Q395-M397 VanDerWaalsContact C-N 3.31Å; Q395-M397 PolarHBondContact O-N 3.41Å; Q395-F398 PolarHBondContact O-N 2.9Å; Q395-F398 VanDerWaalsContact O-N 3.16Å; Q395-T399 PolarHBondContact O-N 3.14Å; Q395-T399 PolarHBondContact O-OG1 2.86Å; Q395-T399 VanDerWaalsContact O-OG1 3.05Å |
| 396 | L | 94.5 | Very high | 94.3 | Very high | 55 Ų | 55 | 47.4 Ų | 47.4 | 29% | 0.288 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -66.7 | -35.3 | -179 | -165.7 | 57 | 0 | 0 | 0 | 111.6 | V387 V390 A391 T393 T399 G400 | V387-L396 HydrophobicContact CG1-CD1 3.69Å; V387-L396 HydrophobicContact CG1-CG 3.94Å; V387-L396 VanDerWaalsContact CG1-O 3.3Å; V387-L396 WeakPolarHBondContact CG1-O 3.44Å; V390-L396 HydrophobicContact CG2-CD2 4.39Å; V390-L396 WeakPolarHBondContact O-CD2 3.33Å; A391-L396 HydrophobicContact CB-CB 4.44Å; A391-L396 HydrophobicContact CB-CG 4.35Å; T393-L396 PolarHBondContact O-N 3.41Å; T393-L396 VanDerWaalsContact O-N 3.13Å; T393-L396 WeakPolarHBondContact OG1-CB 3.44Å; T393-L396 PolarHBondContact OG1-N 3.39Å; L396-T399 WeakPolarHBondContact O-CB 3.35Å; L396-T399 PolarHBondContact O-N 3.32Å; L396-G400 PolarHBondContact O-N 3.47Å |
| 397 | M | 94.8 | Very high | 93.9 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -61.4 | -47.4 | 170.5 | -172.7 | 65.8 | 97.5 | 0 | 0 | 111.5 | Y330 E331 L336 W338 F388 A391 T393 T394 Q395 T399 G400 Y401 | Y330-M397 HydrophobicContact CD1-CE 3.33Å; Y330-M397 HydrophobicContact CE1-CE 3.69Å; Y330-M397 HydrophobicContact CG-CE 4.46Å; E331-M397 HydrophobicContact CG-CE 3.75Å; L336-M397 HydrophobicContact CD1-CE 3.48Å; L336-M397 VanDerWaalsContact CD1-CE 3.48Å; W338-M397 HydrophobicContact CH2-CB 3.99Å; W338-M397 HydrophobicContact CH2-CG 3.44Å; W338-M397 VanDerWaalsContact CH2-CG 3.44Å; W338-M397 HydrophobicContact CZ2-CB 3.78Å; W338-M397 HydrophobicContact CZ2-CG 3.71Å; W338-M397 HydrophobicContact CZ3-CG 4.28Å; F388-M397 HydrophobicContact CD1-SD 3.25Å; F388-M397 WeakPolarHBondContact CD1-SD 3.33Å; F388-M397 HydrophobicContact CE1-CG 4.38Å; F388-M397 VanDerWaalsContact CE1-O 3.29Å; F388-M397 WeakPolarHBondContact CE1-O 3.43Å; F388-M397 HydrophobicContact CE1-SD 3.45Å; F388-M397 WeakPolarHBondContact CE1-SD 3.39Å; F388-M397 HydrophobicContact CG-SD 4.33Å; A391-M397 HydrophobicContact CB-CB 4.42Å; A391-M397 HydrophobicContact CB-SD 4.49Å; T393-M397 PolarHBondContact O-N 3.36Å; T393-M397 VanDerWaalsContact O-N 3.1Å; T394-M397 PolarHBondContact O-N 3.27Å; Q395-M397 VanDerWaalsContact C-N 3.31Å; Q395-M397 PolarHBondContact O-N 3.41Å; M397-T399 VanDerWaalsContact C-N 3.34Å; M397-T399 PolarHBondContact O-N 2.9Å; M397-G400 WeakPolarHBondContact O-CA 3.35Å; M397-G400 PolarHBondContact O-N 2.96Å; M397-G400 VanDerWaalsContact O-N 3.09Å; M397-Y401 HydrophobicContact CG-CE2 3.78Å; M397-Y401 WeakPolarHBondContact O-CD2 3.32Å; M397-Y401 PolarHBondContact O-N 3Å; M397-Y401 VanDerWaalsContact O-N 3.08Å |
| 398 | F | 95.8 | Very high | 93.4 | Very high | 76 Ų | 76 | 45.1 Ų | 45.1 | 33% | 0.333 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -65.2 | -33.7 | 175.6 | -81.3 | -72.3 | 0 | 0 | 0 | 113.7 | W338 L342 T394 Q395 G400 Y401 G402 | W338-F398 HydrophobicContact CH2-CD2 4.29Å; W338-F398 AromaticContact CH2-CE2 3.83Å; W338-F398 HydrophobicContact CH2-CE2 3.83Å; W338-F398 HydrophobicContact CH2-CZ 4.12Å; W338-F398 HydrophobicContact CZ2-CD2 4.32Å; W338-F398 AromaticContact CZ2-CE2 3.97Å; W338-F398 HydrophobicContact CZ2-CE2 3.97Å; L342-F398 HydrophobicContact CD2-CE2 4.1Å; T394-F398 HydrophobicContact CG2-CD2 3.85Å; T394-F398 HydrophobicContact CG2-CE2 3.74Å; T394-F398 VanDerWaalsContact O-CD2 3.27Å; T394-F398 WeakPolarHBondContact O-CD2 3.25Å; T394-F398 PolarHBondContact O-N 3.38Å; Q395-F398 PolarHBondContact O-N 2.9Å; Q395-F398 VanDerWaalsContact O-N 3.16Å; F398-G400 VanDerWaalsContact C-N 3.32Å; F398-Y401 AromaticContact CD1-CD2 3.9Å; F398-Y401 HydrophobicContact CD1-CD2 3.9Å; F398-Y401 HydrophobicContact CD1-CE2 4.41Å; F398-Y401 HydrophobicContact CE1-CD2 4.31Å; F398-Y401 HydrophobicContact CG-CD2 4.46Å; F398-Y401 PolarHBondContact O-N 3.47Å; F398-G402 PolarHBondContact O-N 3.39Å |
| 399 | T | 96.3 | Very high | 93.1 | Very high | 74 Ų | 74 | 45.2 Ų | 45.2 | 45% | 0.454 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -60.7 | -42.4 | 169.8 | -57.1 | 0 | 0 | 0 | 0 | 111 | Q395 L396 M397 G402 L403 | Q395-T399 PolarHBondContact O-N 3.14Å; Q395-T399 PolarHBondContact O-OG1 2.86Å; Q395-T399 VanDerWaalsContact O-OG1 3.05Å; L396-T399 WeakPolarHBondContact O-CB 3.35Å; L396-T399 PolarHBondContact O-N 3.32Å; M397-T399 VanDerWaalsContact C-N 3.34Å; M397-T399 PolarHBondContact O-N 2.9Å; T399-G402 PolarHBondContact O-N 3.38Å; T399-L403 HydrophobicContact CG2-CD1 3.92Å; T399-L403 HydrophobicContact CG2-CG 4.41Å; T399-L403 WeakPolarHBondContact O-CG 3.38Å; T399-L403 PolarHBondContact O-N 2.49Å |
| 400 | G | 95.9 | Very high | 92.8 | Very high | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -57.5 | -47.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | L396 M397 F398 G402 L403 C404 | L396-G400 PolarHBondContact O-N 3.47Å; M397-G400 WeakPolarHBondContact O-CA 3.35Å; M397-G400 PolarHBondContact O-N 2.96Å; M397-G400 VanDerWaalsContact O-N 3.09Å; F398-G400 VanDerWaalsContact C-N 3.32Å; G400-G402 VanDerWaalsContact C-N 3.32Å; G400-G402 PolarHBondContact O-N 2.83Å; G400-L403 PolarHBondContact O-N 2.85Å; G400-C404 PolarHBondContact O-N 3.47Å |
| 401 | Y | 95.1 | Very high | 92.5 | Very high | 10 Ų | 10 | 42.2 Ų | 42.2 | 4% | 0.039 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -61.5 | -41.2 | 175.5 | -62.2 | -54.6 | 0 | 0 | 0 | 112.1 | Y327 E331 W338 G346 A349 L350 F388 M397 F398 L403 C404 | Y327-Y401 HydrophobicContact CD1-CE1 4.4Å; Y327-Y401 HydrophobicContact CE1-CE1 4.44Å; E331-Y401 PolarHBondContact OE1-OH 2.8Å; W338-Y401 HydrophobicContact CH2-CE2 4.06Å; W338-Y401 HydrophobicContact CZ3-CE2 4.41Å; G346-Y401 VanDerWaalsContact CA-CE2 3.43Å; A349-Y401 HydrophobicContact CB-CD2 4.01Å; A349-Y401 HydrophobicContact CB-CG 3.98Å; L350-Y401 HydrophobicContact CB-CE1 4.49Å; F388-Y401 AromaticContact CE1-CD1 3.86Å; F388-Y401 HydrophobicContact CE1-CD1 3.86Å; F388-Y401 AromaticContact CE1-CE1 3.94Å; F388-Y401 HydrophobicContact CE1-CE1 3.94Å; F388-Y401 HydrophobicContact CE1-CG 4.18Å; F388-Y401 AromaticContact CZ-CD1 3.41Å; F388-Y401 HydrophobicContact CZ-CD1 3.41Å; F388-Y401 VanDerWaalsContact CZ-CD1 3.41Å; F388-Y401 AromaticContact CZ-CE1 3.74Å; F388-Y401 HydrophobicContact CZ-CE1 3.74Å; F388-Y401 HydrophobicContact CZ-CG 4.01Å; F388-Y401 VanDerWaalsContact CZ-N 3.3Å; M397-Y401 HydrophobicContact CG-CE2 3.78Å; M397-Y401 WeakPolarHBondContact O-CD2 3.32Å; M397-Y401 PolarHBondContact O-N 3Å; M397-Y401 VanDerWaalsContact O-N 3.08Å; F398-Y401 AromaticContact CD1-CD2 3.9Å; F398-Y401 HydrophobicContact CD1-CD2 3.9Å; F398-Y401 HydrophobicContact CD1-CE2 4.41Å; F398-Y401 HydrophobicContact CE1-CD2 4.31Å; F398-Y401 HydrophobicContact CG-CD2 4.46Å; F398-Y401 PolarHBondContact O-N 3.47Å; Y401-L403 VanDerWaalsContact C-N 3.33Å; Y401-L403 PolarHBondContact O-N 2.95Å; Y401-C404 PolarHBondContact O-N 3.2Å |
| 402 | G | 95 | Very high | 92.2 | Very high | 46 Ų | 46 | 44.7 Ų | 44.7 | 47% | 0.474 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -61.2 | -40 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | F398 T399 G400 F405 | F398-G402 PolarHBondContact O-N 3.39Å; T399-G402 PolarHBondContact O-N 3.38Å; G400-G402 VanDerWaalsContact C-N 3.32Å; G400-G402 PolarHBondContact O-N 2.83Å; G402-F405 WeakPolarHBondContact O-CB 3.09Å; G402-F405 WeakPolarHBondContact O-CD1 3.3Å; G402-F405 PolarHBondContact O-N 2.86Å |
| 403 | L | 95.6 | Very high | 92.2 | Very high | 66 Ų | 66 | 39.1 Ų | 39.1 | 35% | 0.346 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -72.8 | -29.9 | 177.8 | -70 | 167.7 | 0 | 0 | 0 | 112.7 | S380 T383 V387 T399 G400 Y401 F405 | S380-L403 CarbonylContact C-O 3.6Å; S380-L403 WeakPolarHBondContact CB-O 3.45Å; S380-L403 PolarHBondContact OG-O 3.42Å; T383-L403 HydrophobicContact CG2-CD1 4.09Å; T383-L403 HydrophobicContact CG2-CD2 4.49Å; V387-L403 HydrophobicContact CB-CD1 4.45Å; V387-L403 HydrophobicContact CG2-CD1 3.71Å; T399-L403 HydrophobicContact CG2-CD1 3.92Å; T399-L403 HydrophobicContact CG2-CG 4.41Å; T399-L403 WeakPolarHBondContact O-CG 3.38Å; T399-L403 PolarHBondContact O-N 2.49Å; G400-L403 PolarHBondContact O-N 2.85Å; Y401-L403 VanDerWaalsContact C-N 3.33Å; Y401-L403 PolarHBondContact O-N 2.95Å; L403-F405 PolarHBondContact O-N 2.87Å |
| 404 | C | 93 | Very high | 92.1 | Very high | 2 Ų | 2 | 35.9 Ų | 35.9 | 1% | 0.014 | 20% | 0.195 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -80 | 11.9 | 175 | -83.3 | 0 | 0 | 0 | 0 | 114.7 | G384 G400 Y401 L406 F407 | G384-C404 WeakPolarHBondContact CA-SG 3.3Å; G400-C404 PolarHBondContact O-N 3.47Å; Y401-C404 PolarHBondContact O-N 3.2Å; C404-L406 PolarHBondContact O-N 3.1Å; C404-F407 HydrophobicContact CB-CB 4.37Å; C404-F407 WeakPolarHBondContact O-CB 3.21Å; C404-F407 VanDerWaalsContact O-CD1 3.31Å; C404-F407 WeakPolarHBondContact O-CD1 3.42Å; C404-F407 PolarHBondContact O-N 3.49Å |
| 405 | F | 92.4 | Very high | 91.8 | Very high | 98 Ų | 98 | 36.3 Ų | 36.3 | 43% | 0.43 | 19% | 0.191 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -60.4 | -16.4 | -174.2 | 79.6 | -75.8 | 0 | 0 | 0 | 115.4 | S356 S357 G402 L403 | S356-F405 PolarHBondContact OG-O 2.89Å; S357-F405 PolarHBondContact N-O 3.09Å; S357-F405 PolarHBondContact OG-O 3.45Å; G402-F405 WeakPolarHBondContact O-CB 3.09Å; G402-F405 WeakPolarHBondContact O-CD1 3.3Å; G402-F405 PolarHBondContact O-N 2.86Å; L403-F405 PolarHBondContact O-N 2.87Å |
| 406 | L | 92.8 | Very high | 91.4 | Very high | 7 Ų | 7 | 30.7 Ų | 30.7 | 4% | 0.037 | 17% | 0.17 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -109.8 | 11.7 | 176.7 | -62 | 174.9 | 0 | 0 | 0 | 113.7 | S357 M364 V376 S380 C404 M408 A409 | S357-L406 VanDerWaalsContact OG-C 3.25Å; S357-L406 WeakPolarHBondContact OG-CA 3.47Å; M364-L406 HydrophobicContact CE-CD1 3.71Å; M364-L406 HydrophobicContact CE-CD2 3.89Å; M364-L406 HydrophobicContact CE-CG 4.36Å; M364-L406 HydrophobicContact SD-CD1 4.05Å; V376-L406 HydrophobicContact CG1-CD1 3.96Å; S380-L406 PolarHBondContact OG-N 3.02Å; C404-L406 PolarHBondContact O-N 3.1Å; L406-M408 PolarHBondContact O-N 3.15Å; L406-M408 VanDerWaalsContact O-N 3.12Å; L406-A409 HydrophobicContact CB-CB 4.49Å; L406-A409 VanDerWaalsContact O-CB 3.27Å; L406-A409 WeakPolarHBondContact O-CB 3.04Å; L406-A409 PolarHBondContact O-N 3.19Å |
| 407 | F | 89.3 | Confident | 91 | Very high | 13 Ų | 13 | 30 Ų | 30 | 6% | 0.057 | 16% | 0.164 | C | C | . | . | G | 310 helix | trans | -58.5 | -32.7 | -170.9 | 86.4 | -68 | 0 | 0 | 0 | 113.5 | H320 L350 A353 Y354 N381 C404 | H320-F407 AromaticContact CD2-CD2 3.37Å; H320-F407 WeakPolarHBondContact CD2-CD2 3.34Å; H320-F407 AromaticContact CD2-CE2 3.86Å; H320-F407 PolarHBondContact CE1-O 2.93Å; H320-F407 AromaticContact NE2-CD2 3.43Å; H320-F407 WeakPolarHBondContact NE2-CD2 3.38Å; H320-F407 PolarHBondContact NE2-O 2.9Å; L350-F407 HydrophobicContact CD1-CE1 4.41Å; L350-F407 HydrophobicContact CD1-CZ 4.13Å; A353-F407 HydrophobicContact CB-CD1 3.66Å; A353-F407 HydrophobicContact CB-CE1 3.49Å; A353-F407 VanDerWaalsContact CB-CE1 3.49Å; Y354-F407 HydrophobicContact CE2-CZ 4.39Å; N381-F407 HydrophobicContact CB-CB 3.89Å; C404-F407 HydrophobicContact CB-CB 4.37Å; C404-F407 WeakPolarHBondContact O-CB 3.21Å; C404-F407 VanDerWaalsContact O-CD1 3.31Å; C404-F407 WeakPolarHBondContact O-CD1 3.42Å; C404-F407 PolarHBondContact O-N 3.49Å |
| 408 | M | 87.5 | Confident | 90.6 | Very high | 26 Ų | 26 | 30 Ų | 30 | 13% | 0.128 | 17% | 0.165 | C | C | . | . | G | 310 helix | trans | -83.1 | -6.6 | 179.5 | -81.4 | -69.2 | 154 | 0 | 0 | 114.3 | H320 Y354 S357 L406 S410 P412 | H320-M408 HydrophobicContact CB-CE 3.78Å; Y354-M408 HydrophobicContact CD1-CG 4.14Å; Y354-M408 HydrophobicContact CE1-CG 3.97Å; Y354-M408 HydrophobicContact CE1-SD 3.99Å; Y354-M408 HydrophobicContact CE2-CG 4.5Å; Y354-M408 HydrophobicContact CG-CG 4.47Å; S357-M408 PolarHBondContact OG-N 3.43Å; L406-M408 PolarHBondContact O-N 3.15Å; L406-M408 VanDerWaalsContact O-N 3.12Å; M408-S410 VanDerWaalsContact C-N 3.29Å; M408-S410 PolarHBondContact O-N 3.31Å; M408-P412 WeakPolarHBondContact O-CD 3.48Å |
| 409 | A | 89.1 | Confident | 89.9 | Confident | 1 Ų | 1 | 27.5 Ų | 27.5 | 1% | 0.008 | 16% | 0.156 | C | C | . | . | G | 310 helix | trans | -67.4 | -27.5 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | L406 P412 I413 | L406-A409 HydrophobicContact CB-CB 4.49Å; L406-A409 VanDerWaalsContact O-CB 3.27Å; L406-A409 WeakPolarHBondContact O-CB 3.04Å; L406-A409 PolarHBondContact O-N 3.19Å; A409-P412 WeakPolarHBondContact O-CD 3.42Å; A409-P412 WeakPolarHBondContact O-CG 3.47Å; A409-I413 WeakPolarHBondContact O-CD1 3.22Å; A409-I413 WeakPolarHBondContact O-CG1 3.37Å |
| 410 | S | 89.4 | Confident | 89.3 | Confident | 1 Ų | 1 | 30.5 Ų | 30.5 | 1% | 0.007 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -74 | -33.2 | -175.9 | -52.4 | 0 | 0 | 0 | 0 | 113.2 | A374 L378 M408 I413 L414 | A374-S410 PolarHBondContact O-OG 3.49Å; L378-S410 PolarHBondContact N-OG 2.95Å; M408-S410 VanDerWaalsContact C-N 3.29Å; M408-S410 PolarHBondContact O-N 3.31Å; S410-I413 PolarHBondContact O-N 3.4Å; S410-L414 WeakPolarHBondContact O-CG 3.26Å; S410-L414 PolarHBondContact O-N 3.43Å |
| 411 | T | 88.3 | Confident | 88.7 | Confident | 13 Ų | 13 | 31.7 Ų | 31.7 | 8% | 0.08 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -59.4 | -52.2 | -179.1 | -49.2 | 0 | 0 | 0 | 0 | 113.8 | F313 V317 I413 L414 R415 | F313-T411 HydrophobicContact CD2-CG2 4.49Å; F313-T411 HydrophobicContact CE2-CG2 3.77Å; V317-T411 HydrophobicContact CG2-CG2 4.2Å; T411-I413 VanDerWaalsContact C-N 3.29Å; T411-I413 PolarHBondContact O-N 2.83Å; T411-L414 PolarHBondContact O-N 3Å; T411-R415 WeakPolarHBondContact O-CB 3.48Å; T411-R415 PolarHBondContact O-N 2.89Å |
| 412 | P | 84.8 | Confident | 87.9 | Confident | 52 Ų | 52 | 31.7 Ų | 31.7 | 34% | 0.338 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -66 | -31.2 | 178.6 | 25.8 | -34.9 | 0 | 0 | 0 | 112.6 | L361 M408 A409 S416 | L361-P412 HydrophobicContact CD2-CB 4.42Å; L361-P412 HydrophobicContact CD2-CG 3.87Å; M408-P412 WeakPolarHBondContact O-CD 3.48Å; A409-P412 WeakPolarHBondContact O-CD 3.42Å; A409-P412 WeakPolarHBondContact O-CG 3.47Å; P412-S416 WeakPolarHBondContact O-CB 3.27Å; P412-S416 PolarHBondContact O-N 3.3Å |
| 413 | I | 88.4 | Confident | 87 | Confident | 5 Ų | 5 | 31.9 Ų | 31.9 | 3% | 0.026 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -67.8 | -46.5 | 176.4 | -62.8 | 166.7 | 0 | 0 | 0 | 110.5 | L361 D370 V373 A374 A409 S410 T411 R415 S416 K417 | L361-I413 HydrophobicContact CD1-CD1 3.69Å; L361-I413 HydrophobicContact CD1-CG1 3.78Å; D370-I413 HydrophobicContact CB-CG2 4.12Å; V373-I413 HydrophobicContact CB-CD1 3.74Å; V373-I413 HydrophobicContact CG1-CD1 3.76Å; A374-I413 HydrophobicContact CB-CB 4.18Å; A374-I413 HydrophobicContact CB-CD1 3.82Å; A374-I413 HydrophobicContact CB-CG2 3.87Å; A374-I413 VanDerWaalsContact N-CD1 3.33Å; A409-I413 WeakPolarHBondContact O-CD1 3.22Å; A409-I413 WeakPolarHBondContact O-CG1 3.37Å; S410-I413 PolarHBondContact O-N 3.4Å; T411-I413 VanDerWaalsContact C-N 3.29Å; T411-I413 PolarHBondContact O-N 2.83Å; I413-R415 VanDerWaalsContact C-N 3.33Å; I413-R415 PolarHBondContact O-N 3.03Å; I413-S416 WeakPolarHBondContact O-CB 3.47Å; I413-S416 PolarHBondContact O-N 3.01Å; I413-K417 HydrophobicContact CG2-CG 4.33Å; I413-K417 WeakPolarHBondContact O-CG 3.47Å; I413-K417 PolarHBondContact O-N 3.26Å |
| 414 | L | 89.6 | Confident | 85.7 | Confident | 2 Ų | 2 | 33.8 Ų | 33.8 | 1% | 0.01 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -60.1 | -44.5 | 176.3 | -75.1 | 169.9 | 0 | 0 | 0 | 111.3 | Y309 C312 F313 V316 S410 T411 S416 K417 L418 I479 | Y309-L414 HydrophobicContact CD1-CD2 3.72Å; Y309-L414 HydrophobicContact CE1-CD2 4.36Å; C312-L414 HydrophobicContact CB-CD1 4.25Å; C312-L414 HydrophobicContact CB-CD2 3.8Å; F313-L414 HydrophobicContact CB-CB 4.46Å; F313-L414 HydrophobicContact CD2-CB 4.15Å; V316-L414 HydrophobicContact CB-CD1 4.35Å; V316-L414 HydrophobicContact CG2-CD1 4.09Å; S410-L414 WeakPolarHBondContact O-CG 3.26Å; S410-L414 PolarHBondContact O-N 3.43Å; T411-L414 PolarHBondContact O-N 3Å; L414-S416 VanDerWaalsContact C-N 3.33Å; L414-S416 PolarHBondContact O-N 2.89Å; L414-K417 PolarHBondContact O-N 2.7Å; L414-L418 WeakPolarHBondContact O-CG 3.5Å; L414-L418 PolarHBondContact O-N 3.46Å; L414-I479 HydrophobicContact CD2-CD1 3.96Å; L414-I479 HydrophobicContact CD2-CG1 4.49Å |
| 415 | R | 86.2 | Confident | 84.6 | Confident | 59 Ų | 59 | 38.6 Ų | 38.6 | 22% | 0.223 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60.9 | -40.9 | 175.5 | -173.2 | 173.5 | -89.8 | 124 | -7.8 | 111.9 | T411 I413 S419 F431 E438 | T411-R415 WeakPolarHBondContact O-CB 3.48Å; T411-R415 PolarHBondContact O-N 2.89Å; I413-R415 VanDerWaalsContact C-N 3.33Å; I413-R415 PolarHBondContact O-N 3.03Å; R415-S419 PolarHBondContact O-N 3.36Å; R415-S419 VanDerWaalsContact O-N 3.1Å; R415-F431 HydrophobicContact CG-CD1 4.49Å; R415-F431 HydrophobicContact CG-CE1 3.83Å; R415-E438 IonicContact NH2-OE1 2.72Å; R415-E438 IonicContact NH2-OE2 2.87Å; R415-E438 PolarHBondContact NH2-OE2 3.15Å |
| 416 | S | 85 | Confident | 83.5 | Confident | 39 Ų | 39 | 35.2 Ų | 35.2 | 27% | 0.273 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -64.2 | -47.5 | 174.4 | 178.6 | 0 | 0 | 0 | 0 | 112.3 | P412 I413 L414 L418 S419 K420 | P412-S416 WeakPolarHBondContact O-CB 3.27Å; P412-S416 PolarHBondContact O-N 3.3Å; I413-S416 WeakPolarHBondContact O-CB 3.47Å; I413-S416 PolarHBondContact O-N 3.01Å; L414-S416 VanDerWaalsContact C-N 3.33Å; L414-S416 PolarHBondContact O-N 2.89Å; S416-L418 PolarHBondContact O-N 3.05Å; S416-S419 PolarHBondContact O-N 3.17Å; S416-S419 VanDerWaalsContact O-N 3.14Å; S416-S419 PolarHBondContact O-OG 3.24Å; S416-K420 WeakPolarHBondContact O-CG 3.25Å; S416-K420 PolarHBondContact O-N 3.42Å; S416-K420 VanDerWaalsContact O-N 3.11Å |
| 417 | K | 87.2 | Confident | 82.2 | Confident | 40 Ų | 40 | 38.2 Ų | 38.2 | 17% | 0.174 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -59.2 | -45.2 | 177.4 | -71.8 | -76.8 | -171.2 | 168.2 | 0 | 111.5 | Y309 S371 I413 L414 S419 K420 L421 | Y309-K417 HydrophobicContact CD1-CB 4.26Å; Y309-K417 HydrophobicContact CE1-CB 4.16Å; Y309-K417 HydrophobicContact CE1-CG 4.23Å; Y309-K417 HydrophobicContact CG-CB 4.49Å; S371-K417 WeakPolarHBondContact OG-CE 3.39Å; S371-K417 PolarHBondContact OG-NZ 3.07Å; I413-K417 HydrophobicContact CG2-CG 4.33Å; I413-K417 WeakPolarHBondContact O-CG 3.47Å; I413-K417 PolarHBondContact O-N 3.26Å; L414-K417 PolarHBondContact O-N 2.7Å; K417-S419 VanDerWaalsContact C-N 3.33Å; K417-S419 PolarHBondContact O-N 3.4Å; K417-K420 PolarHBondContact O-N 3.38Å; K417-L421 WeakPolarHBondContact O-CG 3.27Å; K417-L421 PolarHBondContact O-N 3.15Å |
| 418 | L | 86 | Confident | 81.1 | Confident | 1 Ų | 1 | 40.1 Ų | 40.1 | 1% | 0.005 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -57.1 | -45.4 | 174.2 | -74 | 169.6 | 0 | 0 | 0 | 111.6 | L306 T310 F313 L414 S416 K420 L421 L430 V434 | L306-L418 HydrophobicContact CD1-CD2 3.89Å; T310-L418 WeakPolarHBondContact OG1-CD2 3.36Å; F313-L418 HydrophobicContact CB-CD1 4.29Å; L414-L418 WeakPolarHBondContact O-CG 3.5Å; L414-L418 PolarHBondContact O-N 3.46Å; S416-L418 PolarHBondContact O-N 3.05Å; L418-K420 VanDerWaalsContact C-N 3.28Å; L418-K420 PolarHBondContact O-N 2.93Å; L418-L421 PolarHBondContact O-N 3.44Å; L418-L421 VanDerWaalsContact O-N 3.17Å; L418-L430 VanDerWaalsContact C-CD2 3.43Å; L418-L430 HydrophobicContact CB-CD1 4.32Å; L418-L430 HydrophobicContact CB-CD2 4.12Å; L418-L430 WeakPolarHBondContact O-CD2 3.39Å; L418-V434 HydrophobicContact CD1-CG2 4.11Å |
| 419 | S | 81.9 | Confident | 80.2 | Confident | 22 Ų | 22 | 39.7 Ų | 39.7 | 15% | 0.154 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -65.8 | -26.4 | -179.6 | 74.9 | 0 | 0 | 0 | 0 | 114.7 | R415 S416 K417 L430 | R415-S419 PolarHBondContact O-N 3.36Å; R415-S419 VanDerWaalsContact O-N 3.1Å; S416-S419 PolarHBondContact O-N 3.17Å; S416-S419 VanDerWaalsContact O-N 3.14Å; S416-S419 PolarHBondContact O-OG 3.24Å; K417-S419 VanDerWaalsContact C-N 3.33Å; K417-S419 PolarHBondContact O-N 3.4Å; S419-L430 VanDerWaalsContact CA-CD2 3.42Å |
| 420 | K | 83.1 | Confident | 79.7 | Confident | 137 Ų | 137 | 39.7 Ų | 39.7 | 60% | 0.596 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -81.1 | -15.4 | 177.2 | -68.6 | 173.9 | -176.6 | 177 | 0 | 112.9 | D370 S416 K417 L418 V422 | D370-K420 IonicContact OD2-NZ 3.79Å; D370-K420 PolarHBondContact OD2-NZ 2.85Å; D370-K420 VanDerWaalsContact OD2-NZ 3.16Å; S416-K420 WeakPolarHBondContact O-CG 3.25Å; S416-K420 PolarHBondContact O-N 3.42Å; S416-K420 VanDerWaalsContact O-N 3.11Å; K417-K420 PolarHBondContact O-N 3.38Å; L418-K420 VanDerWaalsContact C-N 3.28Å; L418-K420 PolarHBondContact O-N 2.93Å; K420-V422 VanDerWaalsContact C-N 3.34Å |
| 421 | L | 82.6 | Confident | 79 | Confident | 26 Ų | 26 | 44 Ų | 44 | 14% | 0.136 | 25% | 0.252 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.2 | -0.8 | 179 | -68 | 172.2 | 0 | 0 | 0 | 113.1 | H302 K305 L306 Y309 K417 L418 | H302-L421 PolarHBondContact NE2-O 3Å; K305-L421 HydrophobicContact CB-CD1 4.25Å; K305-L421 HydrophobicContact CB-CD2 4.48Å; L306-L421 HydrophobicContact CD1-CB 4.38Å; Y309-L421 HydrophobicContact CD2-CD1 3.59Å; Y309-L421 HydrophobicContact CE2-CD1 4.12Å; K417-L421 WeakPolarHBondContact O-CG 3.27Å; K417-L421 PolarHBondContact O-N 3.15Å; L418-L421 PolarHBondContact O-N 3.44Å; L418-L421 VanDerWaalsContact O-N 3.17Å |
| 422 | V | 78.3 | Confident | 78.2 | Confident | 9 Ų | 9 | 44.6 Ų | 44.6 | 6% | 0.055 | 26% | 0.259 | C | S | . | . | S | Bend | trans | -128.1 | 142.9 | -173.3 | 179.7 | 0 | 0 | 0 | 0 | 109.1 | L285 L306 K420 E426 L430 | L285-V422 HydrophobicContact CD1-CB 4.31Å; L285-V422 HydrophobicContact CD1-CG1 3.46Å; L285-V422 VanDerWaalsContact CD1-CG1 3.46Å; L285-V422 HydrophobicContact CD1-CG2 3.85Å; L306-V422 HydrophobicContact CD1-CG2 4.1Å; K420-V422 VanDerWaalsContact C-N 3.34Å; V422-E426 HydrophobicContact CG1-CB 3.39Å; V422-L430 HydrophobicContact CB-CD2 4.37Å; V422-L430 HydrophobicContact CG2-CD1 4.25Å; V422-L430 HydrophobicContact CG2-CD2 4.04Å |
| 423 | D | 75.8 | Confident | 77.8 | Confident | 51 Ų | 51 | 42.7 Ų | 42.7 | 27% | 0.273 | 25% | 0.246 | S | C | . | . | trans | -57.6 | 147.9 | 177.3 | -78.9 | -32 | 0 | 0 | 0 | 111.9 | G290 I291 S292 S425 E426 Q427 | G290-D423 PolarHBondContact O-N 3.35Å; I291-D423 WeakPolarHBondContact CA-OD2 3.45Å; S292-D423 PolarHBondContact N-OD2 3.23Å; D423-S425 PolarHBondContact O-N 2.7Å; D423-S425 VanDerWaalsContact O-N 3.07Å; D423-E426 PolarHBondContact O-N 3.3Å; D423-Q427 PolarHBondContact O-N 2.64Å | ||
| 424 | P | 70 | Confident | 77.4 | Confident | 105 Ų | 105 | 42.6 Ų | 42.6 | 68% | 0.682 | 25% | 0.246 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -54.1 | -30.5 | 178.3 | -27.8 | 35.4 | 0 | 0 | 0 | 114.5 | E426 | P424-E426 VanDerWaalsContact C-N 3.27Å; P424-E426 PolarHBondContact O-N 2.98Å |
| 425 | S | 69.1 | Low | 76.8 | Confident | 104 Ų | 104 | 44.1 Ų | 44.1 | 73% | 0.727 | 26% | 0.259 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.6 | -20.2 | 176.7 | 51.8 | 0 | 0 | 0 | 0 | 113.5 | D423 | D423-S425 PolarHBondContact O-N 2.7Å; D423-S425 VanDerWaalsContact O-N 3.07Å |
| 426 | E | 68.8 | Low | 76.4 | Confident | 27 Ų | 27 | 43.5 Ų | 43.5 | 13% | 0.126 | 26% | 0.263 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -109.5 | 0.2 | -175 | -65.2 | -172 | 172 | 0 | 0 | 113 | L285 G290 S292 V422 D423 P424 G428 A429 L430 | L285-E426 HydrophobicContact CD1-CB 4.28Å; L285-E426 WeakPolarHBondContact CD1-OE2 3.34Å; G290-E426 WeakPolarHBondContact CA-OE2 3.23Å; S292-E426 PolarHBondContact OG-OE1 3.47Å; V422-E426 HydrophobicContact CG1-CB 3.39Å; D423-E426 PolarHBondContact O-N 3.3Å; P424-E426 VanDerWaalsContact C-N 3.27Å; P424-E426 PolarHBondContact O-N 2.98Å; E426-G428 VanDerWaalsContact C-N 3.3Å; E426-G428 PolarHBondContact O-N 3.41Å; E426-A429 PolarHBondContact O-N 3.41Å; E426-A429 VanDerWaalsContact O-N 3.13Å; E426-L430 PolarHBondContact O-N 2.99Å; E426-L430 VanDerWaalsContact O-N 3.1Å |
| 427 | Q | 66.5 | Low | 76.5 | Confident | 69 Ų | 69 | 42.7 Ų | 42.7 | 32% | 0.322 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -58.7 | -36.9 | 178.7 | -73.2 | -176.2 | -4.5 | 0 | 0 | 113.4 | D423 A429 L430 F431 | D423-Q427 PolarHBondContact O-N 2.64Å; Q427-A429 VanDerWaalsContact C-N 3.35Å; Q427-A429 PolarHBondContact O-N 3.47Å; Q427-L430 WeakPolarHBondContact O-CB 3.41Å; Q427-L430 PolarHBondContact O-N 2.97Å; Q427-F431 HydrophobicContact CB-CE2 4.44Å; Q427-F431 WeakPolarHBondContact O-CD2 3.45Å; Q427-F431 PolarHBondContact O-N 2.78Å |
| 428 | G | 64.8 | Low | 76.4 | Confident | 54 Ų | 54 | 42.3 Ų | 42.3 | 56% | 0.557 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -60.8 | -43.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | E426 L430 F431 A432 | E426-G428 VanDerWaalsContact C-N 3.3Å; E426-G428 PolarHBondContact O-N 3.41Å; G428-L430 PolarHBondContact O-N 2.63Å; G428-F431 PolarHBondContact O-N 2.87Å; G428-A432 PolarHBondContact O-N 3.13Å; G428-A432 VanDerWaalsContact O-N 3.1Å |
| 429 | A | 69.7 | Low | 76.2 | Confident | 17 Ų | 17 | 42.5 Ų | 42.5 | 14% | 0.14 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -66.9 | -36.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | A281 E426 Q427 C433 | A281-A429 HydrophobicContact CB-CB 3.99Å; E426-A429 PolarHBondContact O-N 3.41Å; E426-A429 VanDerWaalsContact O-N 3.13Å; Q427-A429 VanDerWaalsContact C-N 3.35Å; Q427-A429 PolarHBondContact O-N 3.47Å; A429-C433 WeakPolarHBondContact O-CB 3.3Å; A429-C433 PolarHBondContact O-N 3.33Å |
| 430 | L | 78.1 | Confident | 76.6 | Confident | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.4 | -49.8 | 174.5 | 176.3 | 71 | 0 | 0 | 0 | 111.8 | L285 L306 L418 S419 V422 E426 Q427 G428 A432 C433 V434 | L285-L430 HydrophobicContact CD2-CB 3.95Å; L285-L430 HydrophobicContact CD2-CD1 4.07Å; L306-L430 HydrophobicContact CD1-CD1 4.46Å; L418-L430 VanDerWaalsContact C-CD2 3.43Å; L418-L430 HydrophobicContact CB-CD1 4.32Å; L418-L430 HydrophobicContact CB-CD2 4.12Å; L418-L430 WeakPolarHBondContact O-CD2 3.39Å; S419-L430 VanDerWaalsContact CA-CD2 3.42Å; V422-L430 HydrophobicContact CB-CD2 4.37Å; V422-L430 HydrophobicContact CG2-CD1 4.25Å; V422-L430 HydrophobicContact CG2-CD2 4.04Å; E426-L430 PolarHBondContact O-N 2.99Å; E426-L430 VanDerWaalsContact O-N 3.1Å; Q427-L430 WeakPolarHBondContact O-CB 3.41Å; Q427-L430 PolarHBondContact O-N 2.97Å; G428-L430 PolarHBondContact O-N 2.63Å; L430-A432 VanDerWaalsContact C-N 3.31Å; L430-A432 PolarHBondContact O-N 2.84Å; L430-C433 WeakPolarHBondContact O-CA 3.33Å; L430-C433 WeakPolarHBondContact O-CB 3.42Å; L430-C433 PolarHBondContact O-N 3.44Å; L430-C433 VanDerWaalsContact O-N 3.09Å; L430-V434 HydrophobicContact CD1-CG2 4.4Å; L430-V434 HydrophobicContact CG-CG2 4.44Å; L430-V434 WeakPolarHBondContact O-CG2 3.14Å; L430-V434 PolarHBondContact O-N 2.93Å |
| 431 | F | 74.1 | Confident | 77 | Confident | 91 Ų | 91 | 38.3 Ų | 38.3 | 40% | 0.399 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -65.6 | -35.7 | -178.6 | -75.5 | -62.5 | 0 | 0 | 0 | 112.5 | R415 Q427 G428 C433 V434 A435 | R415-F431 HydrophobicContact CG-CD1 4.49Å; R415-F431 HydrophobicContact CG-CE1 3.83Å; Q427-F431 HydrophobicContact CB-CE2 4.44Å; Q427-F431 WeakPolarHBondContact O-CD2 3.45Å; Q427-F431 PolarHBondContact O-N 2.78Å; G428-F431 PolarHBondContact O-N 2.87Å; F431-C433 VanDerWaalsContact C-N 3.34Å; F431-V434 PolarHBondContact O-N 3.21Å; F431-A435 PolarHBondContact O-N 3.43Å |
| 432 | A | 71.3 | Confident | 77.3 | Confident | 27 Ų | 27 | 37.3 Ų | 37.3 | 22% | 0.223 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -60.4 | -43.4 | 170 | 0 | 0 | 0 | 0 | 0 | 111.6 | G428 L430 A435 C436 | G428-A432 PolarHBondContact O-N 3.13Å; G428-A432 VanDerWaalsContact O-N 3.1Å; L430-A432 VanDerWaalsContact C-N 3.31Å; L430-A432 PolarHBondContact O-N 2.84Å; A432-A435 PolarHBondContact O-N 3.33Å; A432-C436 PolarHBondContact O-N 3.05Å; A432-C436 VanDerWaalsContact O-N 3.11Å; A432-C436 PolarHBondContact O-SG 3Å; A432-C436 VanDerWaalsContact O-SG 3.33Å |
| 433 | C | 77.5 | Confident | 77.9 | Confident | 11 Ų | 11 | 38.6 Ų | 38.6 | 7% | 0.074 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -63.3 | -45 | 175.6 | -178.6 | 0 | 0 | 0 | 0 | 112.3 | V282 Y286 A429 L430 F431 A435 C436 V437 | V282-C433 HydrophobicContact CG1-CB 4.03Å; V282-C433 HydrophobicContact CG2-CB 4.17Å; Y286-C433 HydrophobicContact CE2-CB 4.3Å; Y286-C433 WeakPolarHBondContact CE2-SG 3.43Å; Y286-C433 PolarHBondContact OH-SG 3.2Å; A429-C433 WeakPolarHBondContact O-CB 3.3Å; A429-C433 PolarHBondContact O-N 3.33Å; L430-C433 WeakPolarHBondContact O-CA 3.33Å; L430-C433 WeakPolarHBondContact O-CB 3.42Å; L430-C433 PolarHBondContact O-N 3.44Å; L430-C433 VanDerWaalsContact O-N 3.09Å; F431-C433 VanDerWaalsContact C-N 3.34Å; C433-A435 VanDerWaalsContact C-N 3.26Å; C433-A435 PolarHBondContact O-N 3.25Å; C433-C436 WeakPolarHBondContact O-CB 3.27Å; C433-C436 PolarHBondContact O-N 2.74Å; C433-C436 VanDerWaalsContact O-N 3.09Å; C433-V437 WeakPolarHBondContact O-CG2 3.26Å; C433-V437 PolarHBondContact O-N 3.17Å |
| 434 | V | 80.4 | Confident | 78.8 | Confident | 4 Ų | 4 | 38.6 Ų | 38.6 | 2% | 0.024 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -57.9 | -40.4 | 177.3 | 170.5 | 0 | 0 | 0 | 0 | 111 | F313 L418 L430 F431 V437 E438 | F313-V434 HydrophobicContact CD1-CG1 4.43Å; F313-V434 HydrophobicContact CE1-CG1 3.69Å; F313-V434 HydrophobicContact CE2-CG1 4.13Å; F313-V434 HydrophobicContact CZ-CG1 3.51Å; L418-V434 HydrophobicContact CD1-CG2 4.11Å; L430-V434 HydrophobicContact CD1-CG2 4.4Å; L430-V434 HydrophobicContact CG-CG2 4.44Å; L430-V434 WeakPolarHBondContact O-CG2 3.14Å; L430-V434 PolarHBondContact O-N 2.93Å; F431-V434 PolarHBondContact O-N 3.21Å; V434-V437 PolarHBondContact O-N 2.86Å; V434-E438 VanDerWaalsContact O-CB 3.29Å; V434-E438 WeakPolarHBondContact O-CB 3.25Å; V434-E438 PolarHBondContact O-N 2.85Å |
| 435 | A | 75.7 | Confident | 79.9 | Confident | 33 Ų | 33 | 33.6 Ų | 33.6 | 27% | 0.273 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -65.4 | -38.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113 | F431 A432 C433 E438 S439 | F431-A435 PolarHBondContact O-N 3.43Å; A432-A435 PolarHBondContact O-N 3.33Å; C433-A435 VanDerWaalsContact C-N 3.26Å; C433-A435 PolarHBondContact O-N 3.25Å; A435-E438 PolarHBondContact O-N 2.58Å; A435-S439 PolarHBondContact O-N 3.09Å; A435-S439 PolarHBondContact O-OG 3.36Å |
| 436 | C | 79.3 | Confident | 81 | Confident | 46 Ų | 46 | 28.7 Ų | 28.7 | 31% | 0.311 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -64.3 | -44.4 | 172.6 | -65.4 | 0 | 0 | 0 | 0 | 111.7 | A432 C433 E438 S439 L440 | A432-C436 PolarHBondContact O-N 3.05Å; A432-C436 VanDerWaalsContact O-N 3.11Å; A432-C436 PolarHBondContact O-SG 3Å; A432-C436 VanDerWaalsContact O-SG 3.33Å; C433-C436 WeakPolarHBondContact O-CB 3.27Å; C433-C436 PolarHBondContact O-N 2.74Å; C433-C436 VanDerWaalsContact O-N 3.09Å; C436-E438 VanDerWaalsContact C-N 3.33Å; C436-S439 PolarHBondContact O-N 3.3Å; C436-L440 PolarHBondContact O-N 3.33Å |
| 437 | V | 85.9 | Confident | 82.1 | Confident | 23 Ų | 23 | 29.7 Ų | 29.7 | 14% | 0.139 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -61.2 | -44.5 | 176.9 | 171.7 | 0 | 0 | 0 | 0 | 110 | T310 F313 F314 C433 V434 S439 L440 C441 | T310-V437 HydrophobicContact CG2-CG2 4.25Å; F313-V437 HydrophobicContact CD1-CG1 3.93Å; F313-V437 HydrophobicContact CE1-CG1 4.3Å; F314-V437 HydrophobicContact CB-CG1 4.03Å; F314-V437 HydrophobicContact CD2-CG1 4.02Å; C433-V437 WeakPolarHBondContact O-CG2 3.26Å; C433-V437 PolarHBondContact O-N 3.17Å; V434-V437 PolarHBondContact O-N 2.86Å; V437-S439 PolarHBondContact O-N 3.19Å; V437-L440 CarbonylContact O-C 3.43Å; V437-L440 WeakPolarHBondContact O-CB 3.3Å; V437-L440 PolarHBondContact O-N 2.98Å; V437-C441 PolarHBondContact O-N 3.36Å; V437-C441 PolarHBondContact O-SG 3.47Å |
| 438 | E | 84.8 | Confident | 83.5 | Confident | 31 Ų | 31 | 29.8 Ų | 29.8 | 15% | 0.145 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.9 | -43.4 | 176.9 | -175.6 | 158.6 | -151.7 | 0 | 0 | 112 | F313 V317 R415 V434 A435 C436 L440 C441 F442 | F313-E438 HydrophobicContact CE1-CB 4.3Å; V317-E438 HydrophobicContact CG1-CG 4.18Å; R415-E438 IonicContact NH2-OE1 2.72Å; R415-E438 IonicContact NH2-OE2 2.87Å; R415-E438 PolarHBondContact NH2-OE2 3.15Å; V434-E438 VanDerWaalsContact O-CB 3.29Å; V434-E438 WeakPolarHBondContact O-CB 3.25Å; V434-E438 PolarHBondContact O-N 2.85Å; A435-E438 PolarHBondContact O-N 2.58Å; C436-E438 VanDerWaalsContact C-N 3.33Å; E438-L440 VanDerWaalsContact C-N 3.31Å; E438-L440 PolarHBondContact O-N 3.33Å; E438-C441 VanDerWaalsContact O-CB 3.27Å; E438-C441 WeakPolarHBondContact O-CB 3.31Å; E438-C441 PolarHBondContact O-N 3.3Å; E438-C441 VanDerWaalsContact O-N 3.1Å; E438-F442 HydrophobicContact CG-CE1 3.64Å; E438-F442 HydrophobicContact CG-CZ 3.67Å; E438-F442 WeakPolarHBondContact O-CD1 3.35Å; E438-F442 WeakPolarHBondContact O-CE1 3.47Å; E438-F442 PolarHBondContact O-N 3.24Å |
| 439 | S | 83.6 | Confident | 84.9 | Confident | 5 Ų | 5 | 27.2 Ų | 27.2 | 4% | 0.035 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -60.5 | -40.5 | 174 | -58.5 | 0 | 0 | 0 | 0 | 112.1 | A435 C436 V437 F442 L443 | A435-S439 PolarHBondContact O-N 3.09Å; A435-S439 PolarHBondContact O-OG 3.36Å; C436-S439 PolarHBondContact O-N 3.3Å; V437-S439 PolarHBondContact O-N 3.19Å; S439-F442 PolarHBondContact O-N 3.22Å; S439-L443 PolarHBondContact O-N 3.02Å |
| 440 | L | 89.3 | Confident | 85.9 | Confident | 71 Ų | 71 | 26.4 Ų | 26.4 | 37% | 0.372 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -66.9 | -36.7 | 174.8 | -176.1 | 65.2 | 0 | 0 | 0 | 111.8 | L129 F314 C436 V437 E438 F442 L443 V444 | L129-L440 HydrophobicContact CD1-CB 4.14Å; L129-L440 HydrophobicContact CD2-CD1 4.2Å; F314-L440 HydrophobicContact CE2-CB 4.49Å; F314-L440 HydrophobicContact CE2-CD2 4.03Å; F314-L440 HydrophobicContact CE2-CG 4Å; C436-L440 PolarHBondContact O-N 3.33Å; V437-L440 CarbonylContact O-C 3.43Å; V437-L440 WeakPolarHBondContact O-CB 3.3Å; V437-L440 PolarHBondContact O-N 2.98Å; E438-L440 VanDerWaalsContact C-N 3.31Å; E438-L440 PolarHBondContact O-N 3.33Å; L440-F442 PolarHBondContact O-N 3.33Å; L440-L443 PolarHBondContact O-N 3.43Å; L440-V444 HydrophobicContact CD1-CG2 4.14Å; L440-V444 HydrophobicContact CG-CG2 4.2Å; L440-V444 WeakPolarHBondContact O-CB 3.43Å; L440-V444 WeakPolarHBondContact O-CG2 3.48Å; L440-V444 PolarHBondContact O-N 3Å |
| 441 | C | 91.9 | Very high | 86.7 | Confident | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -59.4 | -36.2 | 176.2 | -65.9 | 0 | 0 | 0 | 0 | 111.8 | F314 V317 A318 V437 E438 G445 | F314-C441 VanDerWaalsContact CA-SG 3.57Å; F314-C441 WeakPolarHBondContact CD2-SG 3.07Å; F314-C441 PolarHBondContact O-SG 2.92Å; F314-C441 VanDerWaalsContact O-SG 3.37Å; V317-C441 HydrophobicContact CB-CB 4.07Å; V317-C441 HydrophobicContact CG1-CB 3.63Å; A318-C441 HydrophobicContact CB-CB 4.1Å; V437-C441 PolarHBondContact O-N 3.36Å; V437-C441 PolarHBondContact O-SG 3.47Å; E438-C441 VanDerWaalsContact O-CB 3.27Å; E438-C441 WeakPolarHBondContact O-CB 3.31Å; E438-C441 PolarHBondContact O-N 3.3Å; E438-C441 VanDerWaalsContact O-N 3.1Å; C441-G445 WeakPolarHBondContact O-CA 3.19Å; C441-G445 PolarHBondContact O-N 2.91Å |
| 442 | F | 88.5 | Confident | 87.6 | Confident | 6 Ų | 6 | 26.1 Ų | 26.1 | 3% | 0.026 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -71.6 | -41.9 | -177.6 | -64.1 | 5.2 | 0 | 0 | 0 | 110.5 | F125 N189 V317 F321 E438 S439 L440 S446 | F125-F442 HydrophobicContact CD1-CB 4.26Å; F125-F442 HydrophobicContact CD2-CB 4.13Å; F125-F442 HydrophobicContact CE1-CB 4.36Å; F125-F442 HydrophobicContact CE1-CD2 4.21Å; F125-F442 HydrophobicContact CE2-CB 4.23Å; F125-F442 HydrophobicContact CG-CB 4.15Å; F125-F442 HydrophobicContact CZ-CB 4.35Å; N189-F442 VanDerWaalsContact ND2-CD2 3.31Å; N189-F442 WeakPolarHBondContact ND2-CD2 3.5Å; N189-F442 WeakPolarHBondContact ND2-CE2 3.42Å; N189-F442 WeakPolarHBondContact OD1-CE2 3.43Å; V317-F442 HydrophobicContact CG1-CD1 4.38Å; V317-F442 HydrophobicContact CG1-CE1 3.82Å; F321-F442 HydrophobicContact CB-CD1 3.94Å; F321-F442 HydrophobicContact CB-CE1 4.37Å; F321-F442 AromaticContact CD1-CD1 3.77Å; F321-F442 HydrophobicContact CD1-CD1 3.77Å; F321-F442 HydrophobicContact CD1-CD2 4.28Å; F321-F442 AromaticContact CD1-CE1 3.66Å; F321-F442 HydrophobicContact CD1-CE1 3.66Å; F321-F442 HydrophobicContact CD1-CE2 4.08Å; F321-F442 HydrophobicContact CD1-CG 4.16Å; F321-F442 AromaticContact CD1-CZ 3.84Å; F321-F442 HydrophobicContact CD1-CZ 3.84Å; F321-F442 AromaticContact CD2-CD1 3.61Å; F321-F442 HydrophobicContact CD2-CD1 3.61Å; F321-F442 AromaticContact CD2-CE1 3.16Å; F321-F442 HydrophobicContact CD2-CE1 3.16Å; F321-F442 AromaticContact CD2-CZ 3.91Å; F321-F442 HydrophobicContact CD2-CZ 3.91Å; F321-F442 HydrophobicContact CE1-CD1 4.16Å; F321-F442 HydrophobicContact CE1-CD2 4.31Å; F321-F442 AromaticContact CE1-CE1 3.61Å; F321-F442 HydrophobicContact CE1-CE1 3.61Å; F321-F442 AromaticContact CE1-CE2 3.67Å; F321-F442 HydrophobicContact CE1-CE2 3.67Å; F321-F442 AromaticContact CE1-CZ 3.35Å; F321-F442 HydrophobicContact CE1-CZ 3.35Å; F321-F442 HydrophobicContact CE2-CD1 4.02Å; F321-F442 AromaticContact CE2-CE1 3.11Å; F321-F442 HydrophobicContact CE2-CE1 3.11Å; F321-F442 AromaticContact CE2-CZ 3.43Å; F321-F442 HydrophobicContact CE2-CZ 3.43Å; F321-F442 VanDerWaalsContact CE2-CZ 3.43Å; F321-F442 AromaticContact CG-CD1 3.46Å; F321-F442 HydrophobicContact CG-CD1 3.46Å; F321-F442 VanDerWaalsContact CG-CD1 3.46Å; F321-F442 AromaticContact CG-CE1 3.45Å; F321-F442 HydrophobicContact CG-CE1 3.45Å; F321-F442 VanDerWaalsContact CG-CE1 3.45Å; F321-F442 HydrophobicContact CG-CG 4.24Å; F321-F442 HydrophobicContact CG-CZ 4.1Å; F321-F442 HydrophobicContact CZ-CD1 4.28Å; F321-F442 AromaticContact CZ-CE1 3.34Å; F321-F442 HydrophobicContact CZ-CE1 3.34Å; F321-F442 AromaticContact CZ-CE2 3.91Å; F321-F442 HydrophobicContact CZ-CE2 3.91Å; F321-F442 AromaticContact CZ-CZ 3.12Å; F321-F442 HydrophobicContact CZ-CZ 3.12Å; E438-F442 HydrophobicContact CG-CE1 3.64Å; E438-F442 HydrophobicContact CG-CZ 3.67Å; E438-F442 WeakPolarHBondContact O-CD1 3.35Å; E438-F442 WeakPolarHBondContact O-CE1 3.47Å; E438-F442 PolarHBondContact O-N 3.24Å; S439-F442 PolarHBondContact O-N 3.22Å; L440-F442 PolarHBondContact O-N 3.33Å; F442-S446 WeakPolarHBondContact O-CB 3.45Å; F442-S446 PolarHBondContact O-N 3.39Å |
| 443 | L | 90.8 | Very high | 88.7 | Confident | 35 Ų | 35 | 24.9 Ų | 24.9 | 18% | 0.183 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.6 | -51.1 | 174.6 | -172.2 | 72.7 | 0 | 0 | 0 | 111.3 | L122 F125 L129 S439 L440 S447 | L122-L443 HydrophobicContact CD2-CD1 3.5Å; L122-L443 HydrophobicContact CD2-CG 4.31Å; F125-L443 HydrophobicContact CB-CB 4.41Å; F125-L443 HydrophobicContact CB-CD1 4.07Å; L129-L443 HydrophobicContact CD2-CD2 4.04Å; S439-L443 PolarHBondContact O-N 3.02Å; L440-L443 PolarHBondContact O-N 3.43Å; L443-S447 WeakPolarHBondContact O-CB 3.38Å; L443-S447 PolarHBondContact O-N 3.27Å |
| 444 | V | 93.9 | Very high | 89.4 | Confident | 51 Ų | 51 | 25.1 Ų | 25.1 | 31% | 0.309 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -67.3 | -43.2 | -178.3 | 174.1 | 0 | 0 | 0 | 0 | 111.2 | F314 L440 S447 L448 | F314-V444 HydrophobicContact CE2-CG2 4.45Å; F314-V444 HydrophobicContact CZ-CB 4.01Å; F314-V444 HydrophobicContact CZ-CG1 3.93Å; F314-V444 HydrophobicContact CZ-CG2 4.03Å; L440-V444 HydrophobicContact CD1-CG2 4.14Å; L440-V444 HydrophobicContact CG-CG2 4.2Å; L440-V444 WeakPolarHBondContact O-CB 3.43Å; L440-V444 WeakPolarHBondContact O-CG2 3.48Å; L440-V444 PolarHBondContact O-N 3Å; V444-S447 PolarHBondContact O-N 3.04Å; V444-L448 WeakPolarHBondContact O-CB 3.35Å; V444-L448 PolarHBondContact O-N 2.84Å |
| 445 | G | 93.6 | Very high | 90 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -60.2 | -52.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.5 | A318 C441 S447 L448 F449 | A318-G445 WeakPolarHBondContact O-CA 3.1Å; C441-G445 WeakPolarHBondContact O-CA 3.19Å; C441-G445 PolarHBondContact O-N 2.91Å; G445-S447 VanDerWaalsContact C-N 3.34Å; G445-S447 PolarHBondContact O-N 3.48Å; G445-L448 PolarHBondContact O-N 3.09Å; G445-F449 WeakPolarHBondContact O-CB 3.29Å; G445-F449 VanDerWaalsContact O-CD2 3.28Å; G445-F449 WeakPolarHBondContact O-CD2 3.48Å; G445-F449 PolarHBondContact O-N 2.9Å |
| 446 | S | 91.6 | Very high | 90.8 | Very high | 2 Ų | 2 | 28 Ų | 28 | 1% | 0.014 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -58.9 | -45.9 | 176.8 | -174.7 | 0 | 0 | 0 | 0 | 111.6 | S121 E325 F442 N450 | S121-S446 VanDerWaalsContact CB-OG 3.24Å; S121-S446 WeakPolarHBondContact CB-OG 3.35Å; E325-S446 WeakPolarHBondContact OE2-CA 3.42Å; E325-S446 WeakPolarHBondContact OE2-CB 3.49Å; E325-S446 PolarHBondContact OE2-OG 3.45Å; F442-S446 WeakPolarHBondContact O-CB 3.45Å; F442-S446 PolarHBondContact O-N 3.39Å; S446-N450 WeakPolarHBondContact O-CB 3.45Å; S446-N450 PolarHBondContact O-N 3.45Å; S446-N450 PolarHBondContact O-ND2 3.36Å; S446-N450 PolarHBondContact OG-ND2 2.87Å |
| 447 | S | 93.3 | Very high | 91.3 | Very high | 47 Ų | 47 | 26.9 Ų | 26.9 | 33% | 0.329 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -60.9 | -48.1 | 179 | -169.7 | 0 | 0 | 0 | 0 | 113 | L443 V444 G445 S451 | L443-S447 WeakPolarHBondContact O-CB 3.38Å; L443-S447 PolarHBondContact O-N 3.27Å; V444-S447 PolarHBondContact O-N 3.04Å; G445-S447 VanDerWaalsContact C-N 3.34Å; G445-S447 PolarHBondContact O-N 3.48Å; S447-S451 WeakPolarHBondContact O-CB 3.3Å; S447-S451 PolarHBondContact O-N 3.47Å; S447-S451 PolarHBondContact O-OG 3.44Å |
| 448 | L | 95.2 | Very high | 91.2 | Very high | 71 Ų | 71 | 33.6 Ų | 33.6 | 37% | 0.372 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -66.4 | -52.1 | -175.9 | -179.6 | 57.6 | 0 | 0 | 0 | 110.5 | V444 G445 L452 F467 | V444-L448 WeakPolarHBondContact O-CB 3.35Å; V444-L448 PolarHBondContact O-N 2.84Å; G445-L448 PolarHBondContact O-N 3.09Å; L448-L452 WeakPolarHBondContact O-CB 3.19Å; L448-L452 PolarHBondContact O-N 2.68Å; L448-F467 HydrophobicContact CD1-CE1 4.25Å; L448-F467 HydrophobicContact CD2-CE1 3.85Å; L448-F467 HydrophobicContact CG-CE1 4.16Å |
| 449 | F | 94.3 | Very high | 91.3 | Very high | 1 Ų | 1 | 40.1 Ų | 40.1 | 0% | 0.004 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -77.1 | -38.7 | -171.2 | -75.6 | -77.5 | 0 | 0 | 0 | 113.2 | V319 T323 L326 G445 S451 L452 Y453 S464 F467 A468 | V319-F449 HydrophobicContact CG2-CE2 4.42Å; V319-F449 HydrophobicContact CG2-CZ 4.21Å; T323-F449 HydrophobicContact CG2-CD1 4.27Å; T323-F449 HydrophobicContact CG2-CE1 3.94Å; T323-F449 HydrophobicContact CG2-CZ 4.11Å; L326-F449 HydrophobicContact CD1-CB 3.87Å; L326-F449 HydrophobicContact CD1-CD1 4.07Å; L326-F449 HydrophobicContact CD1-CG 4.41Å; L326-F449 HydrophobicContact CG-CB 4.22Å; G445-F449 WeakPolarHBondContact O-CB 3.29Å; G445-F449 VanDerWaalsContact O-CD2 3.28Å; G445-F449 WeakPolarHBondContact O-CD2 3.48Å; G445-F449 PolarHBondContact O-N 2.9Å; F449-S451 VanDerWaalsContact C-N 3.29Å; F449-S451 PolarHBondContact O-N 3.15Å; F449-L452 PolarHBondContact O-N 3.22Å; F449-Y453 VanDerWaalsContact O-CB 3.26Å; F449-Y453 WeakPolarHBondContact O-CB 3.41Å; F449-Y453 PolarHBondContact O-N 2.76Å; F449-S464 WeakPolarHBondContact CE1-O 3.46Å; F449-F467 HydrophobicContact CE1-CD1 4.15Å; F449-F467 HydrophobicContact CZ-CD1 4.37Å; F449-A468 HydrophobicContact CE1-CB 3.7Å; F449-A468 HydrophobicContact CZ-CB 3.72Å |
| 450 | N | 91.4 | Very high | 91.6 | Very high | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -75.4 | -16.8 | 176.2 | -66.2 | -87.3 | 0 | 0 | 0 | 113.5 | L118 E325 S446 P454 | L118-N450 HydrophobicContact CB-CB 3.68Å; L118-N450 HydrophobicContact CD1-CB 4.09Å; L118-N450 HydrophobicContact CG-CB 4.35Å; E325-N450 PolarHBondContact OE2-ND2 2.95Å; S446-N450 WeakPolarHBondContact O-CB 3.45Å; S446-N450 PolarHBondContact O-N 3.45Å; S446-N450 PolarHBondContact O-ND2 3.36Å; S446-N450 PolarHBondContact OG-ND2 2.87Å; N450-P454 WeakPolarHBondContact O-CD 3.42Å; N450-P454 VanDerWaalsContact O-CG 3.3Å; N450-P454 WeakPolarHBondContact O-CG 3.31Å |
| 451 | S | 93.4 | Very high | 91.5 | Very high | 52 Ų | 52 | 40.6 Ų | 40.6 | 36% | 0.364 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -87.4 | -38.5 | 169.6 | -53 | 0 | 0 | 0 | 0 | 111.7 | S447 F449 P454 A455 | S447-S451 WeakPolarHBondContact O-CB 3.3Å; S447-S451 PolarHBondContact O-N 3.47Å; S447-S451 PolarHBondContact O-OG 3.44Å; F449-S451 VanDerWaalsContact C-N 3.29Å; F449-S451 PolarHBondContact O-N 3.15Å; S451-P454 WeakPolarHBondContact O-CD 3.38Å; S451-P454 WeakPolarHBondContact O-CG 3.36Å; S451-A455 WeakPolarHBondContact O-CB 3.34Å |
| 452 | L | 94.5 | Very high | 91.5 | Very high | 33 Ų | 33 | 40.7 Ų | 40.7 | 17% | 0.173 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -69 | -39.1 | -179.5 | -176.9 | 66.5 | 0 | 0 | 0 | 112.1 | L448 F449 A455 T456 F463 F467 | L448-L452 WeakPolarHBondContact O-CB 3.19Å; L448-L452 PolarHBondContact O-N 2.68Å; F449-L452 PolarHBondContact O-N 3.22Å; L452-A455 PolarHBondContact O-N 3.33Å; L452-T456 HydrophobicContact CD1-CG2 3.76Å; L452-T456 HydrophobicContact CG-CG2 4.2Å; L452-T456 WeakPolarHBondContact O-CB 3.34Å; L452-T456 WeakPolarHBondContact O-CG2 3.43Å; L452-T456 PolarHBondContact O-N 2.94Å; L452-T456 VanDerWaalsContact O-N 3.08Å; L452-T456 PolarHBondContact O-OG1 3.05Å; L452-F463 HydrophobicContact CD1-CD1 4.41Å; L452-F463 HydrophobicContact CD1-CE1 4.22Å; L452-F463 HydrophobicContact CD2-CD1 4.42Å; L452-F463 HydrophobicContact CD2-CE1 4.43Å; L452-F463 HydrophobicContact CG-CD1 4.47Å; L452-F467 HydrophobicContact CD2-CB 3.83Å; L452-F467 HydrophobicContact CD2-CD1 3.41Å; L452-F467 VanDerWaalsContact CD2-CD1 3.41Å; L452-F467 HydrophobicContact CD2-CD2 4.39Å; L452-F467 HydrophobicContact CD2-CE1 4.05Å; L452-F467 HydrophobicContact CD2-CG 3.61Å |
| 453 | Y | 94.1 | Very high | 91.9 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -55.3 | -61 | -179 | -174.6 | -103.9 | 0 | 0 | 0 | 112.9 | A114 L326 L329 Y330 F449 A455 T456 L457 K461 S464 | A114-Y453 HydrophobicContact CB-CD1 4.35Å; L326-Y453 HydrophobicContact CD1-CD2 4.13Å; L326-Y453 HydrophobicContact CD1-CG 4.4Å; L326-Y453 HydrophobicContact CD2-CD1 4.42Å; L326-Y453 HydrophobicContact CD2-CD2 4.29Å; L326-Y453 HydrophobicContact CD2-CG 3.9Å; L329-Y453 HydrophobicContact CD2-CD1 3.74Å; L329-Y453 HydrophobicContact CD2-CE1 3.52Å; L329-Y453 HydrophobicContact CG-CE1 3.89Å; Y330-Y453 HydrophobicContact CD2-CE2 4.11Å; F449-Y453 VanDerWaalsContact O-CB 3.26Å; F449-Y453 WeakPolarHBondContact O-CB 3.41Å; F449-Y453 PolarHBondContact O-N 2.76Å; Y453-A455 VanDerWaalsContact C-N 3.29Å; Y453-A455 PolarHBondContact O-N 2.94Å; Y453-T456 PolarHBondContact O-N 2.94Å; Y453-T456 VanDerWaalsContact O-N 3.09Å; Y453-T456 PolarHBondContact O-OG1 3.16Å; Y453-L457 HydrophobicContact CD1-CD2 4.32Å; Y453-L457 HydrophobicContact CE1-CD2 3.84Å; Y453-L457 HydrophobicContact CE2-CD2 4.25Å; Y453-L457 WeakPolarHBondContact O-CG 3.32Å; Y453-L457 PolarHBondContact O-N 3.12Å; Y453-K461 HydrophobicContact CE2-CG 4.19Å; Y453-K461 WeakPolarHBondContact CE2-O 3.33Å; Y453-K461 WeakPolarHBondContact OH-CE 3.08Å; Y453-S464 VanDerWaalsContact CA-OG 3.25Å; Y453-S464 WeakPolarHBondContact CA-OG 3.21Å; Y453-S464 PolarHBondContact N-OG 3.13Å |
| 454 | P | 92.4 | Very high | 92.1 | Very high | 16 Ų | 16 | 41.3 Ų | 41.3 | 10% | 0.104 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -60.5 | -37.2 | 178.8 | 23.7 | -33.4 | 0 | 0 | 0 | 112.9 | T111 A114 N450 S451 T456 L457 | T111-P454 HydrophobicContact CG2-CB 3.77Å; A114-P454 HydrophobicContact CB-CG 4.27Å; N450-P454 WeakPolarHBondContact O-CD 3.42Å; N450-P454 VanDerWaalsContact O-CG 3.3Å; N450-P454 WeakPolarHBondContact O-CG 3.31Å; S451-P454 WeakPolarHBondContact O-CD 3.38Å; S451-P454 WeakPolarHBondContact O-CG 3.36Å; P454-T456 PolarHBondContact O-N 3.37Å; P454-L457 PolarHBondContact O-N 3.2Å |
| 455 | A | 92.8 | Very high | 92.2 | Very high | 80 Ų | 80 | 38.9 Ų | 38.9 | 66% | 0.661 | 21% | 0.21 | S | C | * | . | H | α-helix | trans | -63.5 | -24.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | S451 L452 Y453 | S451-A455 WeakPolarHBondContact O-CB 3.34Å; L452-A455 PolarHBondContact O-N 3.33Å; Y453-A455 VanDerWaalsContact C-N 3.29Å; Y453-A455 PolarHBondContact O-N 2.94Å |
| 456 | T | 92.8 | Very high | 92.4 | Very high | 19 Ų | 19 | 41.3 Ų | 41.3 | 12% | 0.117 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -106.2 | -4.4 | -174 | 55.2 | 0 | 0 | 0 | 0 | 113.8 | L452 Y453 P454 H458 F459 M460 F463 | L452-T456 HydrophobicContact CD1-CG2 3.76Å; L452-T456 HydrophobicContact CG-CG2 4.2Å; L452-T456 WeakPolarHBondContact O-CB 3.34Å; L452-T456 WeakPolarHBondContact O-CG2 3.43Å; L452-T456 PolarHBondContact O-N 2.94Å; L452-T456 VanDerWaalsContact O-N 3.08Å; L452-T456 PolarHBondContact O-OG1 3.05Å; Y453-T456 PolarHBondContact O-N 2.94Å; Y453-T456 VanDerWaalsContact O-N 3.09Å; Y453-T456 PolarHBondContact O-OG1 3.16Å; P454-T456 PolarHBondContact O-N 3.37Å; T456-H458 PolarHBondContact O-N 3.17Å; T456-H458 VanDerWaalsContact O-N 3.15Å; T456-F459 PolarHBondContact O-N 2.78Å; T456-M460 CarbonylContact O-C 3.6Å; T456-M460 PolarHBondContact O-N 3.03Å; T456-F463 HydrophobicContact CG2-CB 4.36Å; T456-F463 HydrophobicContact CG2-CD1 3.5Å; T456-F463 HydrophobicContact CG2-CE1 4.04Å; T456-F463 HydrophobicContact CG2-CG 4.11Å |
| 457 | L | 88.4 | Confident | 92.7 | Very high | 22 Ų | 22 | 44 Ų | 44 | 12% | 0.115 | 23% | 0.234 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55.3 | -32.6 | 177.4 | -70.7 | 179.9 | 0 | 0 | 0 | 113.8 | K107 E110 Y453 P454 K461 | K107-L457 HydrophobicContact CG-CB 4.41Å; K107-L457 HydrophobicContact CG-CD1 4.02Å; E110-L457 HydrophobicContact CB-CD1 3.96Å; E110-L457 WeakPolarHBondContact OE2-CD2 3.22Å; Y453-L457 HydrophobicContact CD1-CD2 4.32Å; Y453-L457 HydrophobicContact CE1-CD2 3.84Å; Y453-L457 HydrophobicContact CE2-CD2 4.25Å; Y453-L457 WeakPolarHBondContact O-CG 3.32Å; Y453-L457 PolarHBondContact O-N 3.12Å; P454-L457 PolarHBondContact O-N 3.2Å; L457-K461 HydrophobicContact CD2-CB 4.32Å; L457-K461 HydrophobicContact CD2-CG 3.83Å |
| 458 | H | 85.6 | Confident | 92.9 | Very high | 163 Ų | 163 | 41.8 Ų | 41.8 | 76% | 0.755 | 22% | 0.219 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -68.5 | -32.9 | 179 | -174.8 | -70.4 | 0 | 0 | 0 | 113 | T456 | T456-H458 PolarHBondContact O-N 3.17Å; T456-H458 VanDerWaalsContact O-N 3.15Å |
| 459 | F | 86.6 | Confident | 93 | Very high | 168 Ų | 168 | 38.6 Ų | 38.6 | 74% | 0.737 | 20% | 0.202 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -98.3 | -55.1 | -175.1 | 172.9 | -107.7 | 0 | 0 | 0 | 111.4 | T456 | T456-F459 PolarHBondContact O-N 2.78Š|
| 460 | M | 89.8 | Confident | 93.2 | Very high | 52 Ų | 52 | 42.8 Ų | 42.8 | 26% | 0.256 | 22% | 0.224 | S | C | . | . | trans | -155.5 | 112.3 | -179.5 | -178.6 | 173.2 | 79.6 | 0 | 0 | 109.9 | T456 G462 F463 L466 | T456-M460 CarbonylContact O-C 3.6Å; T456-M460 PolarHBondContact O-N 3.03Å; M460-G462 VanDerWaalsContact C-N 3.27Å; M460-G462 PolarHBondContact O-N 3.32Å; M460-F463 HydrophobicContact CB-CB 4.14Å; M460-F463 HydrophobicContact CE-CB 3.7Å; M460-F463 HydrophobicContact CE-CD2 3.74Å; M460-F463 HydrophobicContact CE-CG 4.17Å; M460-F463 HydrophobicContact CG-CB 4.45Å; M460-F463 WeakPolarHBondContact O-CB 3.36Å; M460-F463 PolarHBondContact O-N 3.1Å; M460-L466 HydrophobicContact CE-CB 3.99Å; M460-L466 HydrophobicContact CE-CD2 3.56Å; M460-L466 HydrophobicContact CE-CG 4.43Å | ||
| 461 | K | 87.3 | Confident | 93.5 | Very high | 34 Ų | 34 | 43.8 Ų | 43.8 | 15% | 0.148 | 23% | 0.23 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55.5 | -40.9 | -179.2 | -175.4 | -178.6 | 170.5 | -167.6 | 0 | 113.1 | Y330 S333 S334 Y453 L457 F463 | Y330-K461 HydrophobicContact CD2-CD 4.2Å; Y330-K461 HydrophobicContact CD2-CG 3.94Å; Y330-K461 HydrophobicContact CE2-CB 4.36Å; Y330-K461 HydrophobicContact CE2-CD 3.99Å; Y330-K461 HydrophobicContact CE2-CG 3.75Å; Y330-K461 PolarHBondContact O-NZ 3.36Å; S333-K461 VanDerWaalsContact C-NZ 3.29Å; S333-K461 PolarHBondContact O-NZ 3.28Å; S333-K461 VanDerWaalsContact O-NZ 3.17Å; S334-K461 PolarHBondContact O-NZ 2.89Å; Y453-K461 HydrophobicContact CE2-CG 4.19Å; Y453-K461 WeakPolarHBondContact CE2-O 3.33Å; Y453-K461 WeakPolarHBondContact OH-CE 3.08Å; L457-K461 HydrophobicContact CD2-CB 4.32Å; L457-K461 HydrophobicContact CD2-CG 3.83Å; K461-F463 PolarHBondContact O-N 3.03Å |
| 462 | G | 92.2 | Very high | 93.7 | Very high | 2 Ų | 2 | 41.3 Ų | 41.3 | 2% | 0.021 | 21% | 0.213 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -80.5 | 4.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 115 | S389 M460 S464 F465 L466 | S389-G462 WeakPolarHBondContact CA-O 3.25Å; S389-G462 WeakPolarHBondContact CB-O 3.49Å; S389-G462 WeakPolarHBondContact O-CA 3.3Å; M460-G462 VanDerWaalsContact C-N 3.27Å; M460-G462 PolarHBondContact O-N 3.32Å; G462-S464 PolarHBondContact O-N 2.97Å; G462-F465 PolarHBondContact O-N 3.12Å; G462-L466 PolarHBondContact O-N 3.18Å |
| 463 | F | 95.4 | Very high | 93.8 | Very high | 54 Ų | 54 | 44.3 Ų | 44.3 | 24% | 0.237 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -57.1 | -34.9 | -178.3 | -175.8 | -91 | 0 | 0 | 0 | 113.1 | L452 T456 M460 K461 F465 L466 F467 | L452-F463 HydrophobicContact CD1-CD1 4.41Å; L452-F463 HydrophobicContact CD1-CE1 4.22Å; L452-F463 HydrophobicContact CD2-CD1 4.42Å; L452-F463 HydrophobicContact CD2-CE1 4.43Å; L452-F463 HydrophobicContact CG-CD1 4.47Å; T456-F463 HydrophobicContact CG2-CB 4.36Å; T456-F463 HydrophobicContact CG2-CD1 3.5Å; T456-F463 HydrophobicContact CG2-CE1 4.04Å; T456-F463 HydrophobicContact CG2-CG 4.11Å; M460-F463 HydrophobicContact CB-CB 4.14Å; M460-F463 HydrophobicContact CE-CB 3.7Å; M460-F463 HydrophobicContact CE-CD2 3.74Å; M460-F463 HydrophobicContact CE-CG 4.17Å; M460-F463 HydrophobicContact CG-CB 4.45Å; M460-F463 WeakPolarHBondContact O-CB 3.36Å; M460-F463 PolarHBondContact O-N 3.1Å; K461-F463 PolarHBondContact O-N 3.03Å; F463-F465 VanDerWaalsContact C-N 3.27Å; F463-F465 PolarHBondContact O-N 2.87Å; F463-L466 PolarHBondContact O-N 3.38Å; F463-L466 VanDerWaalsContact O-N 3.13Å; F463-F467 HydrophobicContact CD1-CB 4.24Å; F463-F467 HydrophobicContact CE1-CB 3.97Å; F463-F467 HydrophobicContact CE1-CD2 4.41Å; F463-F467 HydrophobicContact CE1-CG 4.48Å; F463-F467 WeakPolarHBondContact O-CB 3.43Å; F463-F467 PolarHBondContact O-N 3.14Å |
| 464 | S | 95.6 | Very high | 94 | Very high | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -59.3 | -38.9 | 177 | -68.3 | 0 | 0 | 0 | 0 | 112.2 | L326 F449 Y453 G462 A468 | L326-S464 VanDerWaalsContact CD1-CB 3.44Å; F449-S464 WeakPolarHBondContact CE1-O 3.46Å; Y453-S464 VanDerWaalsContact CA-OG 3.25Å; Y453-S464 WeakPolarHBondContact CA-OG 3.21Å; Y453-S464 PolarHBondContact N-OG 3.13Å; G462-S464 PolarHBondContact O-N 2.97Å; S464-A468 PolarHBondContact O-N 3.09Å |
| 465 | F | 96.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -71.8 | -37 | 174.8 | -58.7 | -63.6 | 0 | 0 | 0 | 112.3 | T323 L326 Y327 Y330 L385 F388 G462 F463 A468 A469 | T323-F465 HydrophobicContact CG2-CD1 4.2Å; L326-F465 HydrophobicContact CB-CE1 4.21Å; L326-F465 HydrophobicContact CB-CZ 4.02Å; Y327-F465 AromaticContact CD1-CE1 3.94Å; Y327-F465 HydrophobicContact CD1-CE1 3.94Å; Y327-F465 AromaticContact CD1-CZ 3.96Å; Y327-F465 HydrophobicContact CD1-CZ 3.96Å; Y327-F465 HydrophobicContact CE1-CD1 4.43Å; Y327-F465 AromaticContact CE1-CE1 3.72Å; Y327-F465 HydrophobicContact CE1-CE1 3.72Å; Y327-F465 HydrophobicContact CE1-CZ 4.14Å; Y330-F465 HydrophobicContact CD1-CE2 4.26Å; Y330-F465 HydrophobicContact CD2-CD2 4.4Å; Y330-F465 AromaticContact CD2-CE2 3.65Å; Y330-F465 HydrophobicContact CD2-CE2 3.65Å; Y330-F465 HydrophobicContact CE2-CD2 4.49Å; Y330-F465 HydrophobicContact CE2-CE2 4.12Å; Y330-F465 AromaticContact CG-CE2 3.72Å; Y330-F465 HydrophobicContact CG-CE2 3.72Å; Y330-F465 HydrophobicContact CG-CZ 4.37Å; L385-F465 HydrophobicContact CD2-CB 4.4Å; L385-F465 HydrophobicContact CD2-CD1 4.03Å; L385-F465 WeakPolarHBondContact O-CB 3.44Å; F388-F465 HydrophobicContact CB-CB 4.21Å; F388-F465 HydrophobicContact CB-CD1 4.4Å; F388-F465 HydrophobicContact CB-CD2 4.03Å; F388-F465 HydrophobicContact CB-CG 3.97Å; G462-F465 PolarHBondContact O-N 3.12Å; F463-F465 VanDerWaalsContact C-N 3.27Å; F463-F465 PolarHBondContact O-N 2.87Å; F465-A468 WeakPolarHBondContact O-CB 3.45Å; F465-A468 PolarHBondContact O-N 3.14Å; F465-A469 PolarHBondContact O-N 3.36Å |
| 466 | L | 97.3 | Very high | 94.4 | Very high | 52 Ų | 52 | 44.6 Ų | 44.6 | 27% | 0.272 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -64.7 | -42 | 174.5 | -174.6 | 64.9 | 0 | 0 | 0 | 111.6 | V386 M460 G462 F463 A468 A469 I470 | V386-L466 HydrophobicContact CG2-CD1 4.3Å; M460-L466 HydrophobicContact CE-CB 3.99Å; M460-L466 HydrophobicContact CE-CD2 3.56Å; M460-L466 HydrophobicContact CE-CG 4.43Å; G462-L466 PolarHBondContact O-N 3.18Å; F463-L466 PolarHBondContact O-N 3.38Å; F463-L466 VanDerWaalsContact O-N 3.13Å; L466-A468 VanDerWaalsContact C-N 3.34Å; L466-A468 PolarHBondContact O-N 3.08Å; L466-A469 WeakPolarHBondContact O-CB 3.37Å; L466-A469 PolarHBondContact O-N 3.15Å; L466-A469 VanDerWaalsContact O-N 3.16Å; L466-I470 HydrophobicContact CG-CD1 4.29Å; L466-I470 WeakPolarHBondContact O-CG1 3.18Å; L466-I470 PolarHBondContact O-N 3.17Å |
| 467 | F | 97.5 | Very high | 94.5 | Very high | 59 Ų | 59 | 46.8 Ų | 46.8 | 26% | 0.259 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61.6 | -42.9 | 175 | 177.7 | -97.8 | 0 | 0 | 0 | 111.2 | L448 F449 L452 F463 A469 I470 V471 | L448-F467 HydrophobicContact CD1-CE1 4.25Å; L448-F467 HydrophobicContact CD2-CE1 3.85Å; L448-F467 HydrophobicContact CG-CE1 4.16Å; F449-F467 HydrophobicContact CE1-CD1 4.15Å; F449-F467 HydrophobicContact CZ-CD1 4.37Å; L452-F467 HydrophobicContact CD2-CB 3.83Å; L452-F467 HydrophobicContact CD2-CD1 3.41Å; L452-F467 VanDerWaalsContact CD2-CD1 3.41Å; L452-F467 HydrophobicContact CD2-CD2 4.39Å; L452-F467 HydrophobicContact CD2-CE1 4.05Å; L452-F467 HydrophobicContact CD2-CG 3.61Å; F463-F467 HydrophobicContact CD1-CB 4.24Å; F463-F467 HydrophobicContact CE1-CB 3.97Å; F463-F467 HydrophobicContact CE1-CD2 4.41Å; F463-F467 HydrophobicContact CE1-CG 4.48Å; F463-F467 WeakPolarHBondContact O-CB 3.43Å; F463-F467 PolarHBondContact O-N 3.14Å; F467-A469 VanDerWaalsContact C-N 3.32Å; F467-A469 PolarHBondContact O-N 3.37Å; F467-I470 PolarHBondContact O-N 3.42Å; F467-V471 HydrophobicContact CD1-CG2 4.15Å; F467-V471 HydrophobicContact CE1-CG2 3.69Å; F467-V471 HydrophobicContact CE2-CG2 4.25Å; F467-V471 HydrophobicContact CZ-CG2 3.75Å; F467-V471 WeakPolarHBondContact O-CG2 3.22Å; F467-V471 PolarHBondContact O-N 3.18Å |
| 468 | A | 97.5 | Very high | 94.9 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -56.2 | -45.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | V319 T323 L385 F449 S464 F465 L466 I470 V471 L472 | V319-A468 HydrophobicContact CG1-CB 3.71Å; T323-A468 HydrophobicContact CG2-CB 3.51Å; L385-A468 HydrophobicContact CD1-CB 3.9Å; L385-A468 HydrophobicContact CD2-CB 4.22Å; F449-A468 HydrophobicContact CE1-CB 3.7Å; F449-A468 HydrophobicContact CZ-CB 3.72Å; S464-A468 PolarHBondContact O-N 3.09Å; F465-A468 WeakPolarHBondContact O-CB 3.45Å; F465-A468 PolarHBondContact O-N 3.14Å; L466-A468 VanDerWaalsContact C-N 3.34Å; L466-A468 PolarHBondContact O-N 3.08Å; A468-I470 VanDerWaalsContact C-N 3.34Å; A468-I470 PolarHBondContact O-N 3.35Å; A468-V471 PolarHBondContact O-N 3.42Å; A468-L472 WeakPolarHBondContact O-CG 3.44Å; A468-L472 PolarHBondContact O-N 3.22Å |
| 469 | A | 97.8 | Very high | 95.2 | Very high | 3 Ų | 3 | 39.4 Ų | 39.4 | 3% | 0.025 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -60.6 | -42.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | I382 L385 V386 F465 L466 F467 L472 L473 | I382-A469 HydrophobicContact CG2-CB 4.26Å; L385-A469 HydrophobicContact CB-CB 3.97Å; V386-A469 HydrophobicContact CG2-CB 3.89Å; F465-A469 PolarHBondContact O-N 3.36Å; L466-A469 WeakPolarHBondContact O-CB 3.37Å; L466-A469 PolarHBondContact O-N 3.15Å; L466-A469 VanDerWaalsContact O-N 3.16Å; F467-A469 VanDerWaalsContact C-N 3.32Å; F467-A469 PolarHBondContact O-N 3.37Å; A469-L472 PolarHBondContact O-N 3.41Å; A469-L473 PolarHBondContact O-N 3Å |
| 470 | I | 97.8 | Very high | 95.5 | Very high | 89 Ų | 89 | 32.2 Ų | 32.2 | 46% | 0.456 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -62.7 | -44.8 | 176 | -66.7 | 165 | 0 | 0 | 0 | 110.9 | L466 F467 A468 L472 L473 | L466-I470 HydrophobicContact CG-CD1 4.29Å; L466-I470 WeakPolarHBondContact O-CG1 3.18Å; L466-I470 PolarHBondContact O-N 3.17Å; F467-I470 PolarHBondContact O-N 3.42Å; A468-I470 VanDerWaalsContact C-N 3.34Å; A468-I470 PolarHBondContact O-N 3.35Å; I470-L472 VanDerWaalsContact C-N 3.26Å; I470-L472 PolarHBondContact O-N 3.29Å; I470-L473 WeakPolarHBondContact O-CB 3.47Å; I470-L473 PolarHBondContact O-N 3.14Å; I470-L473 VanDerWaalsContact O-N 3.12Å |
| 471 | V | 97.8 | Very high | 95.7 | Very high | 22 Ų | 22 | 32.8 Ų | 32.8 | 13% | 0.133 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -60.4 | -38.1 | 177.4 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | L315 V319 F467 A468 L473 I474 P475 | L315-V471 HydrophobicContact CB-CG1 4.36Å; L315-V471 HydrophobicContact CD2-CG1 4.01Å; V319-V471 HydrophobicContact CG2-CB 4.13Å; V319-V471 HydrophobicContact CG2-CG1 3.76Å; F467-V471 HydrophobicContact CD1-CG2 4.15Å; F467-V471 HydrophobicContact CE1-CG2 3.69Å; F467-V471 HydrophobicContact CE2-CG2 4.25Å; F467-V471 HydrophobicContact CZ-CG2 3.75Å; F467-V471 WeakPolarHBondContact O-CG2 3.22Å; F467-V471 PolarHBondContact O-N 3.18Å; A468-V471 PolarHBondContact O-N 3.42Å; V471-L473 VanDerWaalsContact C-N 3.29Å; V471-L473 PolarHBondContact O-N 3.09Å; V471-I474 WeakPolarHBondContact O-CB 3.29Å; V471-I474 PolarHBondContact O-N 2.99Å; V471-P475 WeakPolarHBondContact O-CD 3.46Å |
| 472 | L | 97.4 | Very high | 95.9 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -72 | -15.2 | 177.7 | -69.2 | -179.3 | 0 | 0 | 0 | 114.6 | V316 V319 L378 N381 I382 L385 A468 A469 I470 I474 P475 A476 | V316-L472 HydrophobicContact CB-CD2 4.49Å; V316-L472 HydrophobicContact CG2-CD2 4.04Å; V319-L472 HydrophobicContact CB-CD2 4.01Å; V319-L472 HydrophobicContact CB-CG 4.29Å; V319-L472 HydrophobicContact CG1-CD1 3.87Å; V319-L472 HydrophobicContact CG1-CD2 4.11Å; V319-L472 HydrophobicContact CG1-CG 3.92Å; V319-L472 HydrophobicContact CG2-CD2 4.09Å; V319-L472 HydrophobicContact CG2-CG 4.23Å; L378-L472 HydrophobicContact CD2-CD2 4.3Å; N381-L472 HydrophobicContact CB-CD1 4.17Å; N381-L472 WeakPolarHBondContact ND2-CD1 3.44Å; I382-L472 HydrophobicContact CD1-CB 4.02Å; I382-L472 HydrophobicContact CG1-CB 3.66Å; I382-L472 HydrophobicContact CG1-CD1 4.25Å; L385-L472 HydrophobicContact CD1-CD1 3.56Å; A468-L472 WeakPolarHBondContact O-CG 3.44Å; A468-L472 PolarHBondContact O-N 3.22Å; A469-L472 PolarHBondContact O-N 3.41Å; I470-L472 VanDerWaalsContact C-N 3.26Å; I470-L472 PolarHBondContact O-N 3.29Å; L472-I474 PolarHBondContact O-N 3.46Å; L472-P475 HydrophobicContact CD2-CG 4.31Å; L472-P475 VanDerWaalsContact O-CD 3.25Å; L472-P475 WeakPolarHBondContact O-CD 3.45Å; L472-P475 VanDerWaalsContact O-CG 3.28Å; L472-P475 WeakPolarHBondContact O-CG 3.22Å; L472-A476 PolarHBondContact O-N 3.25Å |
| 473 | L | 97.6 | Very high | 95.7 | Very high | 96 Ų | 96 | 32.4 Ų | 32.4 | 50% | 0.503 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -65.5 | -29.5 | 170.4 | -67 | 171 | 0 | 0 | 0 | 111.7 | I382 A469 I470 V471 A476 A477 | I382-L473 HydrophobicContact CD1-CD2 3.94Å; I382-L473 HydrophobicContact CD1-CG 4.47Å; A469-L473 PolarHBondContact O-N 3Å; I470-L473 WeakPolarHBondContact O-CB 3.47Å; I470-L473 PolarHBondContact O-N 3.14Å; I470-L473 VanDerWaalsContact O-N 3.12Å; V471-L473 VanDerWaalsContact C-N 3.29Å; V471-L473 PolarHBondContact O-N 3.09Å; L473-A476 PolarHBondContact O-N 2.66Å; L473-A477 VanDerWaalsContact O-CB 3.32Å; L473-A477 WeakPolarHBondContact O-CB 3.48Å; L473-A477 PolarHBondContact O-N 3.04Å |
| 474 | I | 97.6 | Very high | 95.4 | Very high | 84 Ų | 84 | 32.7 Ų | 32.7 | 43% | 0.431 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -62.1 | -57.4 | 178.3 | -57.6 | 170.5 | 0 | 0 | 0 | 111.4 | L315 V471 L472 A476 A477 I478 | L315-I474 HydrophobicContact CD1-CB 4.06Å; L315-I474 HydrophobicContact CD1-CG2 3.83Å; V471-I474 WeakPolarHBondContact O-CB 3.29Å; V471-I474 PolarHBondContact O-N 2.99Å; L472-I474 PolarHBondContact O-N 3.46Å; I474-A476 VanDerWaalsContact C-N 3.27Å; I474-A476 PolarHBondContact O-N 2.99Å; I474-A477 PolarHBondContact O-N 3.48Å; I474-I478 HydrophobicContact CG2-CD1 3.83Å; I474-I478 WeakPolarHBondContact O-CG1 3.38Å; I474-I478 PolarHBondContact O-N 2.99Å |
| 475 | P | 96.6 | Very high | 95 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.9 | -33 | 176.4 | 23.3 | -32.1 | 0 | 0 | 0 | 112.6 | C312 L315 V316 L378 V471 L472 I478 I479 | C312-P475 HydrophobicContact CB-CB 3.87Å; L315-P475 HydrophobicContact CB-CG 4.49Å; V316-P475 HydrophobicContact CG2-CB 4.06Å; V316-P475 HydrophobicContact CG2-CG 3.89Å; L378-P475 HydrophobicContact CD1-CB 4.36Å; L378-P475 HydrophobicContact CD2-CG 4.49Å; V471-P475 WeakPolarHBondContact O-CD 3.46Å; L472-P475 HydrophobicContact CD2-CG 4.31Å; L472-P475 VanDerWaalsContact O-CD 3.25Å; L472-P475 WeakPolarHBondContact O-CD 3.45Å; L472-P475 VanDerWaalsContact O-CG 3.28Å; L472-P475 WeakPolarHBondContact O-CG 3.22Å; P475-I478 PolarHBondContact O-N 2.7Å; P475-I479 WeakPolarHBondContact O-CB 3.26Å; P475-I479 WeakPolarHBondContact O-CD1 3.45Å; P475-I479 WeakPolarHBondContact O-CG1 3.37Å; P475-I479 PolarHBondContact O-N 3.34Å |
| 476 | A | 96.2 | Very high | 94.4 | Very high | 18 Ų | 18 | 39.1 Ų | 39.1 | 15% | 0.149 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.3 | -46.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | L375 L378 L472 L473 I474 G480 | L375-A476 HydrophobicContact CD2-CB 4.28Å; L375-A476 VanDerWaalsContact CD2-O 3.25Å; L375-A476 WeakPolarHBondContact CD2-O 3.44Å; L378-A476 HydrophobicContact CB-CB 4.43Å; L378-A476 HydrophobicContact CD1-CB 3.95Å; L472-A476 PolarHBondContact O-N 3.25Å; L473-A476 PolarHBondContact O-N 2.66Å; I474-A476 VanDerWaalsContact C-N 3.27Å; I474-A476 PolarHBondContact O-N 2.99Å; A476-G480 PolarHBondContact O-N 3.19Å |
| 477 | A | 96.2 | Very high | 93.8 | Very high | 64 Ų | 64 | 39.4 Ų | 39.4 | 53% | 0.529 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -64 | -43.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | L473 I474 G480 A481 | L473-A477 VanDerWaalsContact O-CB 3.32Å; L473-A477 WeakPolarHBondContact O-CB 3.48Å; L473-A477 PolarHBondContact O-N 3.04Å; I474-A477 PolarHBondContact O-N 3.48Å; A477-G480 PolarHBondContact O-N 3.22Å; A477-A481 WeakPolarHBondContact O-CB 3.25Å; A477-A481 PolarHBondContact O-N 2.91Å |
| 478 | I | 95.4 | Very high | 93.2 | Very high | 28 Ų | 28 | 45.9 Ų | 45.9 | 14% | 0.144 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -62.8 | -49.8 | 178.7 | -67.7 | 168.5 | 0 | 0 | 0 | 110.9 | L308 L311 I474 P475 G480 A481 L482 | L308-I478 HydrophobicContact CB-CG2 3.96Å; L308-I478 HydrophobicContact CD1-CG2 4.49Å; L308-I478 HydrophobicContact CD2-CD1 4.22Å; L308-I478 HydrophobicContact CD2-CG2 4.11Å; L308-I478 HydrophobicContact CG-CG2 4.42Å; L311-I478 HydrophobicContact CD2-CD1 4.32Å; I474-I478 HydrophobicContact CG2-CD1 3.83Å; I474-I478 WeakPolarHBondContact O-CG1 3.38Å; I474-I478 PolarHBondContact O-N 2.99Å; P475-I478 PolarHBondContact O-N 2.7Å; I478-G480 VanDerWaalsContact C-N 3.34Å; I478-G480 PolarHBondContact O-N 3.25Å; I478-A481 PolarHBondContact O-N 3.44Å; I478-L482 HydrophobicContact CG2-CD1 3.95Å; I478-L482 HydrophobicContact CG2-CG 4.42Å; I478-L482 WeakPolarHBondContact O-CB 3.27Å; I478-L482 WeakPolarHBondContact O-CG 3.12Å; I478-L482 PolarHBondContact O-N 3.19Å |
| 479 | I | 93.6 | Very high | 92.5 | Very high | 3 Ų | 3 | 50.3 Ų | 50.3 | 2% | 0.015 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -63.5 | -42.8 | -179.6 | -66 | 167.6 | 0 | 0 | 0 | 110.4 | Y309 A374 L375 L378 L414 P475 Q483 | Y309-I479 HydrophobicContact CE1-CG1 4.41Å; A374-I479 HydrophobicContact CB-CD1 4.36Å; L375-I479 HydrophobicContact CD2-CB 4.16Å; L375-I479 HydrophobicContact CD2-CG2 4.13Å; L375-I479 HydrophobicContact CG-CG2 4.09Å; L378-I479 HydrophobicContact CD1-CD1 3.88Å; L414-I479 HydrophobicContact CD2-CD1 3.96Å; L414-I479 HydrophobicContact CD2-CG1 4.49Å; P475-I479 WeakPolarHBondContact O-CB 3.26Å; P475-I479 WeakPolarHBondContact O-CD1 3.45Å; P475-I479 WeakPolarHBondContact O-CG1 3.37Å; P475-I479 PolarHBondContact O-N 3.34Å; I479-Q483 WeakPolarHBondContact O-CB 3.34Å; I479-Q483 PolarHBondContact O-N 3.25Å |
| 480 | G | 93.2 | Very high | 91.7 | Very high | 17 Ų | 17 | 56 Ų | 56 | 18% | 0.175 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -62.3 | -45.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | A476 A477 I478 Q483 C484 | A476-G480 PolarHBondContact O-N 3.19Å; A477-G480 PolarHBondContact O-N 3.22Å; I478-G480 VanDerWaalsContact C-N 3.34Å; I478-G480 PolarHBondContact O-N 3.25Å; G480-Q483 PolarHBondContact O-N 3.39Å; G480-C484 PolarHBondContact O-N 3.47Å; G480-C484 PolarHBondContact O-SG 3Å; G480-C484 VanDerWaalsContact O-SG 3.39Å |
| 481 | A | 92.9 | Very high | 91 | Very high | 63 Ų | 63 | 58.6 Ų | 58.6 | 52% | 0.521 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -64.3 | -44.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | A477 I478 Q483 C484 F485 | A477-A481 WeakPolarHBondContact O-CB 3.25Å; A477-A481 PolarHBondContact O-N 2.91Å; I478-A481 PolarHBondContact O-N 3.44Å; A481-Q483 VanDerWaalsContact C-N 3.33Å; A481-Q483 PolarHBondContact O-N 2.83Å; A481-C484 PolarHBondContact O-N 3.36Å; A481-F485 WeakPolarHBondContact O-CB 3.4Å; A481-F485 PolarHBondContact O-N 3.17Å |
| 482 | L | 90.9 | Very high | 90.1 | Very high | 19 Ų | 19 | 66 Ų | 66 | 10% | 0.099 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -62.5 | -40.8 | 176.5 | -73 | 176.4 | 0 | 0 | 0 | 111.6 | K305 L308 Y309 I478 F485 D486 | K305-L482 HydrophobicContact CG-CD2 4.12Å; L308-L482 HydrophobicContact CB-CD1 4.35Å; L308-L482 HydrophobicContact CD1-CD1 4.33Å; L308-L482 HydrophobicContact CD1-CD2 4.15Å; Y309-L482 HydrophobicContact CD2-CD1 4.39Å; Y309-L482 HydrophobicContact CE1-CD1 4.33Å; Y309-L482 HydrophobicContact CE2-CD1 3.87Å; I478-L482 HydrophobicContact CG2-CD1 3.95Å; I478-L482 HydrophobicContact CG2-CG 4.42Å; I478-L482 WeakPolarHBondContact O-CB 3.27Å; I478-L482 WeakPolarHBondContact O-CG 3.12Å; I478-L482 PolarHBondContact O-N 3.19Å; L482-F485 PolarHBondContact O-N 3.49Å; L482-D486 WeakPolarHBondContact O-CB 3.46Å; L482-D486 VanDerWaalsContact O-CG 3.29Å; L482-D486 PolarHBondContact O-N 2.95Å |
| 483 | Q | 88.7 | Confident | 89.2 | Confident | 10 Ų | 10 | 69.2 Ų | 69.2 | 5% | 0.047 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -64.7 | -45.4 | 176.9 | -177.7 | 63.2 | 25.9 | 0 | 0 | 112.1 | S371 I479 G480 A481 F485 D486 Q487 | S371-Q483 PolarHBondContact OG-OE1 3.04Å; I479-Q483 WeakPolarHBondContact O-CB 3.34Å; I479-Q483 PolarHBondContact O-N 3.25Å; G480-Q483 PolarHBondContact O-N 3.39Å; A481-Q483 VanDerWaalsContact C-N 3.33Å; A481-Q483 PolarHBondContact O-N 2.83Å; Q483-F485 VanDerWaalsContact C-N 3.29Å; Q483-F485 PolarHBondContact O-N 2.62Å; Q483-D486 PolarHBondContact O-N 3.16Å; Q483-Q487 WeakPolarHBondContact O-CG 3.06Å; Q483-Q487 PolarHBondContact O-N 3.17Å |
| 484 | C | 88.1 | Confident | 88.3 | Confident | 59 Ų | 59 | 67.6 Ų | 67.6 | 40% | 0.399 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -62.1 | -38.2 | 175.8 | -75 | 0 | 0 | 0 | 0 | 111.9 | G480 A481 R488 | G480-C484 PolarHBondContact O-N 3.47Å; G480-C484 PolarHBondContact O-SG 3Å; G480-C484 VanDerWaalsContact O-SG 3.39Å; A481-C484 PolarHBondContact O-N 3.36Å; C484-R488 WeakPolarHBondContact O-CB 3.39Å; C484-R488 VanDerWaalsContact O-CG 3.28Å; C484-R488 WeakPolarHBondContact O-CG 3.29Å; C484-R488 PolarHBondContact O-N 3.39Å; C484-R488 VanDerWaalsContact O-N 3.07Å |
| 485 | F | 87.3 | Confident | 87.2 | Confident | 99 Ų | 99 | 66.7 Ų | 66.7 | 43% | 0.434 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -65.2 | -44.8 | 176.4 | -173 | -89.8 | 0 | 0 | 0 | 111.6 | L301 A481 L482 Q483 R488 R489 | L301-F485 HydrophobicContact CD1-CE1 4.43Å; L301-F485 HydrophobicContact CD2-CE1 4Å; L301-F485 HydrophobicContact CD2-CZ 4.5Å; A481-F485 WeakPolarHBondContact O-CB 3.4Å; A481-F485 PolarHBondContact O-N 3.17Å; L482-F485 PolarHBondContact O-N 3.49Å; Q483-F485 VanDerWaalsContact C-N 3.29Å; Q483-F485 PolarHBondContact O-N 2.62Å; F485-R488 PolarHBondContact O-N 2.62Å; F485-R489 PolarHBondContact O-N 3.1Å |
| 486 | D | 84.4 | Confident | 86 | Confident | 36 Ų | 36 | 69.8 Ų | 69.8 | 19% | 0.193 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -65 | -43.2 | 179.8 | -72.5 | -14.8 | 0 | 0 | 0 | 111.3 | K305 L482 Q483 R488 R489 E490 | K305-D486 VanDerWaalsContact NZ-CG 3.28Å; K305-D486 IonicContact NZ-OD1 3.77Å; K305-D486 PolarHBondContact NZ-OD1 3.43Å; K305-D486 IonicContact NZ-OD2 3.98Å; K305-D486 PolarHBondContact NZ-OD2 2.92Å; K305-D486 VanDerWaalsContact NZ-OD2 3.13Å; L482-D486 WeakPolarHBondContact O-CB 3.46Å; L482-D486 VanDerWaalsContact O-CG 3.29Å; L482-D486 PolarHBondContact O-N 2.95Å; Q483-D486 PolarHBondContact O-N 3.16Å; D486-R488 PolarHBondContact O-N 2.91Å; D486-R489 PolarHBondContact O-N 2.01Å; D486-E490 WeakPolarHBondContact O-CG 3.3Å; D486-E490 PolarHBondContact O-N 2.85Å |
| 487 | Q | 84.9 | Confident | 84.5 | Confident | 59 Ų | 59 | 76.3 Ų | 76.3 | 28% | 0.276 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.9 | -39.9 | 174.3 | -74.8 | -177.4 | -21.5 | 0 | 0 | 113.1 | Q483 R489 E490 H491 | Q483-Q487 WeakPolarHBondContact O-CG 3.06Å; Q483-Q487 PolarHBondContact O-N 3.17Å; Q487-R489 VanDerWaalsContact C-N 3.33Å; Q487-E490 PolarHBondContact O-N 3.37Å; Q487-H491 PolarHBondContact O-CD2 3.16Å; Q487-H491 VanDerWaalsContact O-CD2 3.31Å; Q487-H491 PolarHBondContact O-N 3.03Å |
| 488 | R | 85.9 | Confident | 82.9 | Confident | 194 Ų | 194 | 81.5 Ų | 81.5 | 73% | 0.732 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -65.6 | -37.2 | 176.7 | -77 | 176.5 | -177.9 | -169 | 1.4 | 112 | C484 F485 D486 R492 | C484-R488 WeakPolarHBondContact O-CB 3.39Å; C484-R488 VanDerWaalsContact O-CG 3.28Å; C484-R488 WeakPolarHBondContact O-CG 3.29Å; C484-R488 PolarHBondContact O-N 3.39Å; C484-R488 VanDerWaalsContact O-N 3.07Å; F485-R488 PolarHBondContact O-N 2.62Å; D486-R488 PolarHBondContact O-N 2.91Å; R488-R492 WeakPolarHBondContact O-CB 3.35Å; R488-R492 PolarHBondContact O-N 3.38Å |
| 489 | R | 82.6 | Confident | 80.9 | Confident | 93 Ų | 93 | 83.3 Ų | 83.3 | 35% | 0.351 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -66.1 | -47.1 | 176.6 | -165.6 | 177.4 | -179.1 | 173.4 | 4 | 110.6 | E299 F485 D486 Q487 H491 R492 D493 | E299-R489 IonicContact OE2-NH2 2.87Å; F485-R489 PolarHBondContact O-N 3.1Å; D486-R489 PolarHBondContact O-N 2.01Å; Q487-R489 VanDerWaalsContact C-N 3.33Å; R489-H491 VanDerWaalsContact C-N 3.33Å; R489-H491 PolarHBondContact O-N 3.25Å; R489-R492 PolarHBondContact O-N 3.1Å; R489-R492 VanDerWaalsContact O-N 3.13Å; R489-D493 WeakPolarHBondContact O-CB 3.42Å; R489-D493 PolarHBondContact O-N 3.13Å |
| 490 | E | 81.7 | Confident | 79.1 | Confident | 122 Ų | 122 | 90.1 Ų | 90.1 | 57% | 0.57 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -58.4 | -42.5 | 175.8 | -72.8 | 177.1 | 171.7 | 0 | 0 | 112.6 | D486 Q487 S494 | D486-E490 WeakPolarHBondContact O-CG 3.3Å; D486-E490 PolarHBondContact O-N 2.85Å; Q487-E490 PolarHBondContact O-N 3.37Å; E490-S494 WeakPolarHBondContact O-CB 3.48Å; E490-S494 PolarHBondContact O-N 3.05Å; E490-S494 PolarHBondContact O-OG 2.95Å |
| 491 | H | 81.1 | Confident | 76.5 | Confident | 144 Ų | 144 | 97.2 Ų | 97.2 | 67% | 0.667 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.7 | -40.7 | 175.1 | -87.3 | -59.9 | 0 | 0 | 0 | 112.8 | Q487 R489 A495 | Q487-H491 PolarHBondContact O-CD2 3.16Å; Q487-H491 VanDerWaalsContact O-CD2 3.31Å; Q487-H491 PolarHBondContact O-N 3.03Å; R489-H491 VanDerWaalsContact C-N 3.33Å; R489-H491 PolarHBondContact O-N 3.25Å; H491-A495 WeakPolarHBondContact O-CB 3.45Å; H491-A495 PolarHBondContact O-N 3.44Å |
| 492 | R | 79.6 | Confident | 75.7 | Confident | 179 Ų | 179 | 99 Ų | 99 | 68% | 0.675 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -66.3 | -43.1 | 178.4 | -166.4 | 179.4 | 80.6 | 176.2 | 8.3 | 111.5 | R488 R489 A495 S496 | R488-R492 WeakPolarHBondContact O-CB 3.35Å; R488-R492 PolarHBondContact O-N 3.38Å; R489-R492 PolarHBondContact O-N 3.1Å; R489-R492 VanDerWaalsContact O-N 3.13Å; R492-A495 PolarHBondContact O-N 2.97Å; R492-S496 PolarHBondContact O-N 2.9Å |
| 493 | D | 78.8 | Confident | 74.9 | Confident | 67 Ų | 67 | 103.2 Ų | 103.2 | 36% | 0.358 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -67.7 | -39.8 | -179.9 | -63.3 | -13.5 | 0 | 0 | 0 | 110 | R489 S496 H497 | R489-D493 WeakPolarHBondContact O-CB 3.42Å; R489-D493 PolarHBondContact O-N 3.13Å; D493-S496 PolarHBondContact O-N 3.16Å; D493-S496 PolarHBondContact O-OG 3.22Å; D493-H497 PolarHBondContact O-N 3.5Å; D493-H497 VanDerWaalsContact O-N 3.14Å |
| 494 | S | 78.4 | Confident | 74.1 | Confident | 62 Ų | 62 | 108.3 Ų | 108.3 | 43% | 0.434 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -61.9 | -45.5 | 172.1 | -57.6 | 0 | 0 | 0 | 0 | 112.3 | E490 S496 H497 F498 | E490-S494 WeakPolarHBondContact O-CB 3.48Å; E490-S494 PolarHBondContact O-N 3.05Å; E490-S494 PolarHBondContact O-OG 2.95Å; S494-S496 VanDerWaalsContact C-N 3.31Å; S494-S496 PolarHBondContact O-N 3.13Å; S494-H497 PolarHBondContact O-N 2.73Å; S494-F498 WeakPolarHBondContact O-CD2 3.46Å; S494-F498 PolarHBondContact O-N 3.33Å |
| 495 | A | 74.8 | Confident | 73.3 | Confident | 65 Ų | 65 | 111.2 Ų | 111.2 | 54% | 0.537 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -63.9 | -35.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | H491 R492 F498 G499 | H491-A495 WeakPolarHBondContact O-CB 3.45Å; H491-A495 PolarHBondContact O-N 3.44Å; R492-A495 PolarHBondContact O-N 2.97Å; A495-F498 PolarHBondContact O-N 2.74Å; A495-G499 PolarHBondContact O-N 3.05Å; A495-G499 VanDerWaalsContact O-N 3.17Å |
| 496 | S | 71.8 | Confident | 72.4 | Confident | 65 Ų | 65 | 112 Ų | 112 | 46% | 0.455 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -68.4 | -32.4 | 175.5 | 72.1 | 0 | 0 | 0 | 0 | 113.2 | R492 D493 S494 | R492-S496 PolarHBondContact O-N 2.9Å; D493-S496 PolarHBondContact O-N 3.16Å; D493-S496 PolarHBondContact O-OG 3.22Å; S494-S496 VanDerWaalsContact C-N 3.31Å; S494-S496 PolarHBondContact O-N 3.13Å |
| 497 | H | 63.8 | Low | 71.6 | Confident | 155 Ų | 155 | 117.1 Ų | 117.1 | 72% | 0.718 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -72.7 | -31.9 | 175.2 | -93.6 | -68.7 | 0 | 0 | 0 | 113.4 | D493 S494 | D493-H497 PolarHBondContact O-N 3.5Å; D493-H497 VanDerWaalsContact O-N 3.14Å; S494-H497 PolarHBondContact O-N 2.73Å |
| 498 | F | 62.4 | Low | 70.7 | Confident | 172 Ų | 172 | 121.2 Ų | 121.2 | 75% | 0.754 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -82.9 | -14 | 176 | -82.6 | -78.2 | 0 | 0 | 0 | 114 | S494 A495 | S494-F498 WeakPolarHBondContact O-CD2 3.46Å; S494-F498 PolarHBondContact O-N 3.33Å; A495-F498 PolarHBondContact O-N 2.74Å |
| 499 | G | 55.1 | Low | 69.5 | Low | 66 Ų | 66 | 115.6 Ų | 115.6 | 68% | 0.68 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.8 | 5.5 | 179 | 0 | 0 | 0 | 0 | 0 | 115.6 | A495 | A495-G499 PolarHBondContact O-N 3.05Å; A495-G499 VanDerWaalsContact O-N 3.17Å |
| 500 | I | 53.8 | Low | 68.4 | Low | 147 Ų | 147 | 117.5 Ų | 117.5 | 75% | 0.754 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.2 | 3.4 | -177.6 | -61.1 | 173 | 0 | 0 | 0 | 112.1 | ||
| 501 | S | 39.5 | Very low | 67.2 | Low | 166 Ų | 166 | 117.1 Ų | 117.1 | 100% | 1.161 | 65% | 0.654 | S | S | * | * | trans | -87.9 | 0 | 176.6 | 64.2 | 0 | 0 | 0 | 0 | 113.6 |
Retrieved 501 of 501 residues in 145.3 ms
(Link to these results)